Catalog Number |
ACM209459110-1 |
CAS |
209459-11-0 |
Structure |
|
IUPAC Name |
methyl 2-amino-1,3-benzothiazole-7-carboxylate |
Synonyms |
Methyl 2-aminobenzo[d]thiazole-7-carboxylate;209459-11-0;methyl 2-amino-1,3-benzothiazole-7-carboxylate;Methyl 2-aminobenzothiazole-7-carboxylate;7-Benzothiazolecarboxylic acid, 2-amino-, methyl ester;ACMC-209fg0;SCHEMBL984327;DTXSID40448063;CS-D0509;ANW-24286;BBL022748;MFCD09263762;STL255681;ZINC20759789;AKOS000368897;FS-2998;MCULE-7816576012;AC-27167;AK-31614;AM803501;methyl 2-amino-benzothiazole-7-carboxylate;AB0023352;DB-066381;FT-0743883;W4387;S-5745;2-Aminobenzothiazole-7-carboxylic acid methyl ester;J-521943;2-amino-benzothiazole-7-carboxylic Acid Methyl Ester;7-Benzothiazolecarboxylic Acid,2-Amino-,Methyl Ester |
Molecular Weight |
208.24g/mol |
Molecular Formula |
C9H8N2O2S |
Canonical SMILES |
COC(=O)C1=C2C(=CC=C1)N=C(S2)N |
InChI |
InChI=1S/C9H8N2O2S/c1-13-8(12)5-3-2-4-6-7(5)14-9(10)11-6/h2-4H,1H3,(H2,10,11) |
InChI Key |
JIASYIASCIMIOB-UHFFFAOYSA-N |
Complexity |
237 |
Covalently-Bonded Unit Count |
1 |
Exact Mass |
208.03064868g/mol |
Heavy Atom Count |
14 |
Hydrogen Bond Acceptor Count |
5 |
Monoisotopic Mass |
208.03064868g/mol |
Rotatable Bond Count |
2 |
Topological Polar Surface Area |
93.4Ų |
X Log P3 |
1.9 |