3-(2-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-(2-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V008-3787 |
| Compound Name: | 3-(2-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C22 H17 N3 O4 S |
| Smiles: | COc1ccccc1N1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6838 |
| logD: | 3.6833 |
| logSw: | -4.0085 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.87 |
| InChI Key: | SGXCYRBQBURCSX-UHFFFAOYSA-N |