2-[(2,4-dinitrophenyl)sulfanyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(2,4-dinitrophenyl)sulfanyl]quinazolin-4(3H)-one
2-[(2,4-dinitrophenyl)sulfanyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 0614-1112 |
| Compound Name: | 2-[(2,4-dinitrophenyl)sulfanyl]quinazolin-4(3H)-one |
| Molecular Weight: | 344.3 |
| Molecular Formula: | C14 H8 N4 O5 S |
| Smiles: | c1ccc2c(c1)C(NC(=N2)Sc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2502 |
| logD: | 2.3252 |
| logSw: | -3.9291 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.963 |
| InChI Key: | DKIQDIQJQPRRDL-UHFFFAOYSA-N |