6-chloro-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-phenylquinazoline
Chemical Structure Depiction of
6-chloro-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-phenylquinazoline
6-chloro-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-phenylquinazoline
Compound characteristics
| Compound ID: | Y020-5313 |
| Compound Name: | 6-chloro-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-phenylquinazoline |
| Molecular Weight: | 407.88 |
| Molecular Formula: | C21 H14 Cl N3 O2 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1nc(c2ccccc2)c2cc(ccc2n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1026 |
| logD: | 6.1026 |
| logSw: | -6.3776 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.855 |
| InChI Key: | IRVUAMSCEGEZEN-UHFFFAOYSA-N |