3-cyclopentyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-cyclopentyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-cyclopentyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-3874 |
| Compound Name: | 3-cyclopentyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | C1CCC(C1)N1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8998 |
| logD: | 3.8998 |
| logSw: | -4.1618 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.74 |
| InChI Key: | RYTFTVZTJVSICS-UHFFFAOYSA-N |