methyl 2-{[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}-5-(2-phenylethyl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-{[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}-5-(2-phenylethyl)-1,3-thiazole-4-carboxylate
methyl 2-{[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}-5-(2-phenylethyl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-2622 |
| Compound Name: | methyl 2-{[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}-5-(2-phenylethyl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | Cc1c(C(Nc2nc(C(=O)OC)c(CCc3ccccc3)s2)=O)sc(n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6056 |
| logD: | 4.626 |
| logSw: | -5.4528 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.432 |
| InChI Key: | OMHXRZRUEHZWOM-UHFFFAOYSA-N |