prop-2-en-1-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
prop-2-en-1-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4340-0822 |
| Compound Name: | prop-2-en-1-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 392.88 |
| Molecular Formula: | C17 H13 Cl N2 O3 S2 |
| Smiles: | Cc1c(C(=O)OCC=C)sc(NC(c2c(c3ccccc3s2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8952 |
| logD: | 4.0022 |
| logSw: | -4.8595 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.748 |
| InChI Key: | BXNYQBQQFSCXLC-UHFFFAOYSA-N |