ethyl 2-(4-chloro-N-cyclopropyl-3-nitrobenzamido)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-chloro-N-cyclopropyl-3-nitrobenzamido)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(4-chloro-N-cyclopropyl-3-nitrobenzamido)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | Y501-1373 |
Compound Name: | ethyl 2-(4-chloro-N-cyclopropyl-3-nitrobenzamido)-4-methyl-1,3-thiazole-5-carboxylate |
Molecular Weight: | 409.85 |
Molecular Formula: | C17 H16 Cl N3 O5 S |
Smiles: | CCOC(c1c(C)nc(N(C2CC2)C(c2ccc(c(c2)[N+]([O-])=O)[Cl])=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.8919 |
logD: | 3.8919 |
logSw: | -4.4072 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 79.505 |
InChI Key: | MIAPLRBVIVKYNE-UHFFFAOYSA-N |