N-cyclopentyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-cyclopentyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | J084-0736 |
| Compound Name: | N-cyclopentyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C23 H23 N5 O S |
| Smiles: | Cc1cccc(c1)c1nc2ccccc2c2nnc(n12)SCC(NC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6701 |
| logD: | 4.6572 |
| logSw: | -4.4803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.873 |
| InChI Key: | LNHIEASHOJXRLL-UHFFFAOYSA-N |