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99464-64-9

Basic Information
CAS No.: 99464-64-9
Name: Ampiroxicam
Article Data: 2
Molecular Structure:
Molecular Structure of 99464-64-9 (Ampiroxicam)
Formula: C20H21N3O7S
Molecular Weight: 447.469
Synonyms: ethyl 1-[[9-methyl-10,10-dioxo-8-(pyridin-2-ylcarbamoyl)-10$l^{6}-thia-9-azabicyclo[4.4.0]deca-1,3,5,7-tetraen-7-yl]oxy]ethyl carbonate;Ampiroxicamum [Latin];Flucam (TN);Flucam;(+-)-4-(1-Hydroxyethoxy)-2-methyl-N-2-pyridyl-2H-1,2-benzothiazine-3-carboxamide ethyl carbonate (ester), 1,1-dioxide;Ampiroxicam (+-);Ampiroxicam (JAN);Carbonic acid, ethyl 1-((2-methyl-3-((2-pyridinylamino)carbonyl)-2H-1,2-benzothiazin-4-yl)oxy)ethyl ester, S,S-dioxide;Ampiroxicam [BAN:INN:JAN];Carbonic acid,esters,ethyl 1-[[2-methyl-1,1-dioxido-3-[(2- pyridinylamino)carbonyl]-2H-1,2- benzothiazin-4-yl]oxy]ethyl ester;CP 65703;Ampiroxicam 99%;Ampiroxicamum;
EINECS: 807-877-6
Density: 1.44 g/cm3
Melting Point: 159-161?C
Appearance: Powder
PSA: 132.51000
LogP: 3.65040
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Chemistry


IUPAC Name:  Ethyl 1-[2-methyl-1,1-dioxo-3-(pyridin-2-ylcarbamoyl)benzo[e]thiazin-4-yl]oxyethyl carbonate
Molecular Formula: C20H21N3O7S
Molecular Weight: 447.46 g/mol
SMILES: c1(NC(C2=C(c3c(cccc3)S(=O)(=O)N2C)O[C@@H](OC(OCC)=O)C)=O)ccccn1
InChI: InChI=1/C20H21N3O7S/c1-4-28-20(25)30-13(2)29-18-14-9-5-6-10-15(14)31(26,27)23(3)17(18)19(24)22-16-11-7-8-12-21-16/h5-13H,4H2,1-3H3,(H,21,22,24)
Classification Code: Drug / Therapeutic Agent; Reproductive Effect
XLogP3: 4
H-Bond Donor: 1
H-Bond Acceptor: 9
Index of Refraction: 1.629 
Molar Refractivity: 110.12 cm
Molar Volume: 309.6 cm3 
Polarizability: 43.65×10-24 cm3 
Surface Tension: 67 dyne/cm 
Density of Ampiroxicam (CAS NO.99464-64-9): 1.44 g/cm3

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
monkey LD50 oral > 500mg/kg (500mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 36, Pg. 432, 1994.
mouse LD50 intraperitoneal 1358mg/kg (1358mg/kg)   Drugs in Japan Vol. -, Pg. 119, 1995.
mouse LD50 oral 2291mg/kg (2291mg/kg)   Drugs in Japan Vol. -, Pg. 119, 1995.
mouse LD50 subcutaneous 4259mg/kg (4259mg/kg)   Drugs in Japan Vol. -, Pg. 119, 1995.
rat LD50 intraperitoneal 282mg/kg (282mg/kg)   Drugs in Japan Vol. -, Pg. 119, 1995.
rat LD50 oral 747mg/kg (747mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH
GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE
KIDNEY, URETER, AND BLADDER: INCONTINENCE
Oyo Yakuri. Pharmacometrics. Vol. 43, Pg. 1, 1992.
rat LD50 subcutaneous 2598mg/kg (2598mg/kg)   Drugs in Japan Vol. -, Pg. 119, 1995.

Specification

 Ampiroxicam (CAS NO.99464-64-9), its Synonyms are Ampiroxicamum ; (+-)-4-(1-Hydroxyethoxy)-2-methyl-N-2-pyridyl-2H-1,2-benzothiazine-3-carboxamide ethyl carbonate (ester), 1,1-dioxide ; Carbonic acid, ethyl 1-((2-methyl-3-((2-pyridinylamino)carbonyl)-2H-1,2-benzothiazin-4-yl)oxy)ethyl ester, S,S-dioxide .