N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0460 |
| Compound Name: | N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 422.33 |
| Molecular Formula: | C19 H17 Cl2 N3 O2 S |
| Smiles: | CCCN1C(c2ccc(cc2NC1=S)C(NCc1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6222 |
| logD: | 4.6196 |
| logSw: | -4.7158 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.981 |
| InChI Key: | KSFCLGPBTCMNRB-UHFFFAOYSA-N |