N-[(4-methylphenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
N-[(4-methylphenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Compound characteristics
| Compound ID: | K297-1116 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C21 H19 N5 O S2 |
| Smiles: | Cc1ccc(CNC(Cc2csc(NC3c4ccccc4NC(N=3)=S)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0539 |
| logD: | 1.3992 |
| logSw: | -4.2021 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.481 |
| InChI Key: | OBXKSTSBVHWUQH-UHFFFAOYSA-N |