CAS No.37682-72-7,ANTIPAIN, DIHYDROCHLORIDE Suppliers,MSDS download

Products Categories

Others (9)
Organic Chemicals (9)
Pharmaceutical (8)
Reagent (5)

Basic Information

Molecular Structure:
CAS No.:	37682-72-7
Name:	ANTIPAIN, DIHYDROCHLORIDE

Formula:	C₂₇H₄₆Cl₂N₁₀O₆
Molecular Weight:	677.62
Synonyms:	L-Valinamide,N2-[[[(1S)-1-carboxy-2-phenylethyl]amino]carbonyl]-L-arginyl-N-[4-[(aminoiminomethyl)amino]-1-formylbutyl]-,dihydrochloride (9CI);
EINECS:	253-631-0
Density:	1.2423 (rough estimate)
Boiling Point:	1020.2 °C at 760 mmHg
Flash Point:	570.8 °C
Solubility:	50 mg/mL in water
Appearance:	White to off-white powder.
Safety:	22-24/25
PSA:	277.50000
LogP:	4.25060

Total:26 Page 1 of 1 1

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 37682-72-7

Chemistry

Molecular Formula: C₂₇H₄₆Cl₂N₁₀O₆
Molar mass: 677.6235 g/mol
EINECS: 253-631-0
Storage temp: -20°C
Solubility: H₂O: 50 mg/mL
Structure of Antipain dihydrochloride (37682-72-7):

IUPAC Name: 2-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-2-[[5-
(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methylbutanoyl]
amino]-1-oxopentan-2-yl]carbamoylamino]-3-phenylpropanoic acid
dihydrochloride
H-Bond Donor: 11
H-Bond Acceptor: 13
Canonical SMILES: CC(C)C(C(=O)NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(CCCN=C(N)N)C=O.Cl.Cl
Isomeric SMILES: CC(C)[C@@H](C(=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(CCCN=C(N)N)C=O.Cl.Cl
InChI: InChI=1S/C27H44N10O6.2ClH/c1-16(2)21(34-18(15-38)10-6-12-32-25(28)29)23(40)37-22(39)19(11-7-13-33-26(30)31)35-27(43)36-20(24(41)42)14-17-8-4-3-
5-9-17;;/h3-5,8-9,15-16,18-21,34H,6-7,10-14H2,1-2H3,(H,41,42)(H4,28,29,
32)(H4,30,31,33)(H2,35,36,43)(H,37,39,40);2*1H/t18?,19-,20?,21-;;/m0../s1
InChIKey: GXQPAKIVOCLCHD-BXLPLHKWSA-N

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD	intraperitoneal	> 1gm/kg (1000mg/kg)		Journal of Antibiotics. Vol. 25, Pg. 263, 1972.
mouse	LDLo	intravenous	250mg/kg (250mg/kg)		Journal of Antibiotics. Vol. 25, Pg. 263, 1972.

Safety Profile

Safety Statements:
22: Do not breathe dust
24: Avoid contact with skin
25: Avoid contact with eyes

Specification

Antipain dihydrochloride (37682-72-7) also can be called for L-Valinamide, N(sup 2)-(((1-carboxy-2-phenylethyl)amino)carbonyl)-L-arginyl-N-(4-((aminoiminomethyl)amino)-1-formylbutyl)-, dihydrochloride .