N-cyclopropyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}propanamide
Chemical Structure Depiction of
N-cyclopropyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}propanamide
N-cyclopropyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}propanamide
Compound characteristics
| Compound ID: | J084-0738 |
| Compound Name: | N-cyclopropyl-2-{[5-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}propanamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C22 H21 N5 O S |
| Smiles: | CC(C(NC1CC1)=O)Sc1nnc2c3ccccc3nc(c3cccc(C)c3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4377 |
| logD: | 4.4189 |
| logSw: | -4.3316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.051 |
| InChI Key: | BMJITMXPVACHFI-AWEZNQCLSA-N |