Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]-

Base Information

Chemical Name:Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]-
CAS No.:781605-91-2
Molecular Formula:C₂₈H₃₂N₆O₃
Molecular Weight:500.6
Hs Code.:
Mol file:781605-91-2.mol

Synonyms:OLXNMGAZOATHQI-UHFFFAOYSA-N;4-[(3-carbamimidoylanilino)methyl]-3-[[4-(4-methyl-1,4-diazepan-1-yl)benzoyl]amino]benzoic acid;Benzoic acid, 4-[[[3-(aMinoiMinoMethyl)phenyl]aMino]Methyl]-3-[[4-(hexahydro-4-Methyl-1H-1,4-diazepin-1-yl)benzoyl]aMino]-

Suppliers and Price of Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
4-[[[3-(AMINOIMINOMETHYL)PHENYL]AMINO]METHYL]-3-[[4-(HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)BENZOYL]AMINO]BENZOIC ACID 95.00%
5MG
$ 496.56

Total 4 raw suppliers

Chemical Property of Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]-

Chemical Property:

PSA：134.78000
LogP:4.62410

Purity/Quality:

99% ^*data from raw suppliers

4-[[[3-(AMINOIMINOMETHYL)PHENYL]AMINO]METHYL]-3-[[4-(HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)BENZOYL]AMINO]BENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]-

There total 10 articles about Benzoic acid, 4-[[[3-(aminoiminomethyl)phenyl]amino]methyl]-3-[[4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)benzoyl]amino]- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 761392-41-0
ethyl 4-[({3-[amino(imino)methyl]phenyl}amino)methyl]-3-{[4-(4-methyl-1,4-diazepan-1-yl)benzoyl]amino}benzoate

: 781605-91-2
4-[(3-carbamimidoyl-phenylamino)-methyl]-3-[4-(4-methyl-[1,4]diazepan-1-yl)-benzoylamino]-benzoic acid

Guidance literature:: With sodium hydroxide; In ethanol; water; at 20 ℃; for 3h;
DOI:10.1016/j.bmc.2004.11.005

Reference yield:

: 96315-16-1
4-bromomethyl-3-nitrobenzoic acid ethyl ester

: 781605-91-2
4-[(3-carbamimidoyl-phenylamino)-methyl]-3-[4-(4-methyl-[1,4]diazepan-1-yl)-benzoylamino]-benzoic acid

Guidance literature:: Multi-step reaction with 6 steps

1: 12.63 g / potassium carbonate / acetonitrile / 3 h / 70 °C

2: Fe; ammonium chloride / ethanol; H₂O / 0.5 h / Heating

3: pyridine / 20 h / 20 °C

4: HCl / CHCl₃ / 24 h / 5 °C

5: ammonium acetate / ethanol / 36 h / 20 °C

6: NaOH / ethanol; H₂O / 3 h / 20 °C

With pyridine; ammonium acetate; hydrogenchloride; sodium hydroxide; ammonium chloride; iron; potassium carbonate; In ethanol; chloroform; water; acetonitrile; 4: Pinner reaction;
DOI:10.1016/j.bmc.2004.11.005

Reference yield:

: 166438-80-8
4-(4-Methyl-1,4-diazepan-1-yl)benzonitrile

: 781605-91-2
4-[(3-carbamimidoyl-phenylamino)-methyl]-3-[4-(4-methyl-[1,4]diazepan-1-yl)-benzoylamino]-benzoic acid

Guidance literature:: Multi-step reaction with 6 steps

1: 98 percent / NaOH / 40 h / Heating

2: thionyl chloride / 2 h / 60 °C

3: pyridine / 20 h / 20 °C

4: HCl / CHCl₃ / 24 h / 5 °C

5: ammonium acetate / ethanol / 36 h / 20 °C

6: NaOH / ethanol; H₂O / 3 h / 20 °C

With pyridine; ammonium acetate; hydrogenchloride; sodium hydroxide; thionyl chloride; In ethanol; chloroform; water; 4: Pinner reaction;
DOI:10.1016/j.bmc.2004.11.005