N-[(3-chloro-4-fluorophenyl)methyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | M057-2401 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-4-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 377.87 |
| Molecular Formula: | C18 H17 Cl F N3 O S |
| Smiles: | CC(C)c1c(C(NCc2ccc(c(c2)[Cl])F)=O)sc(n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3881 |
| logD: | 5.373 |
| logSw: | -5.9242 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.229 |
| InChI Key: | VHQMMPYDTUSMSN-UHFFFAOYSA-N |