2-({2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1-methyl-6-oxo-N-phenyl-1,6-dihydropyrimidine-5-carboxamide
Chemical Structure Depiction of
2-({2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1-methyl-6-oxo-N-phenyl-1,6-dihydropyrimidine-5-carboxamide
2-({2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1-methyl-6-oxo-N-phenyl-1,6-dihydropyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G856-6385 |
| Compound Name: | 2-({2-[(1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-1-methyl-6-oxo-N-phenyl-1,6-dihydropyrimidine-5-carboxamide |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C21 H17 N5 O3 S2 |
| Smiles: | CN1C(=NC=C(C(Nc2ccccc2)=O)C1=O)SCC(Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9402 |
| logD: | 2.3905 |
| logSw: | -3.5254 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.799 |
| InChI Key: | KBIMSVOKPJREDN-UHFFFAOYSA-N |