3-butyl-6-(morpholin-4-yl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-butyl-6-(morpholin-4-yl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-butyl-6-(morpholin-4-yl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-7075 |
| Compound Name: | 3-butyl-6-(morpholin-4-yl)-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | CCCCN1C(=Nc2ccc(cc2C1=O)N1CCOCC1)SCc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1477 |
| logD: | 4.1477 |
| logSw: | -4.0853 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.763 |
| InChI Key: | FXXLPHUSJSYKQP-UHFFFAOYSA-N |