3-[(2-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[(2-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[(2-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0593 |
| Compound Name: | 3-[(2-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C23 H19 N3 O4 S |
| Smiles: | COc1ccccc1CN1C(=Nc2ccccc2C1=O)SCc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5818 |
| logD: | 4.5818 |
| logSw: | -4.5538 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.783 |
| InChI Key: | GOOXPPIXDBFERH-UHFFFAOYSA-N |