4-oxo-3-pentyl-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
4-oxo-3-pentyl-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
4-oxo-3-pentyl-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061371 |
| Compound Name: | 4-oxo-3-pentyl-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C26 H25 N3 O3 S |
| Smiles: | CCCCCN1C(c2ccc(cc2NC1=S)C(Nc1ccc(cc1)Oc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4091 |
| logD: | 6.3977 |
| logSw: | -5.5741 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.407 |
| InChI Key: | AWFHGXOBDYWGNK-UHFFFAOYSA-N |