N-benzyl-2-{[(4-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
Chemical Structure Depiction of
N-benzyl-2-{[(4-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
N-benzyl-2-{[(4-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0068 |
| Compound Name: | N-benzyl-2-{[(4-chlorophenyl)methyl]sulfanyl}quinazolin-4-amine |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C22 H18 Cl N3 S |
| Smiles: | C(c1ccccc1)Nc1c2ccccc2nc(n1)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9178 |
| logD: | 5.916 |
| logSw: | -6.377 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8494 |
| InChI Key: | CFMMZAKMXZICMZ-UHFFFAOYSA-N |