4-oxo-3-propyl-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
4-oxo-3-propyl-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
4-oxo-3-propyl-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0131 |
| Compound Name: | 4-oxo-3-propyl-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C18 H18 N4 O2 S |
| Smiles: | CCCN1C(c2ccc(cc2NC1=S)C(NCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3534 |
| logD: | 2.3507 |
| logSw: | -3.1291 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.524 |
| InChI Key: | RSNILSSVROQKTQ-UHFFFAOYSA-N |