cyclopropyl[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
cyclopropyl[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
cyclopropyl[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V016-5866 |
| Compound Name: | cyclopropyl[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C24 H24 N6 O |
| Smiles: | C1CN(CCN(C1)c1nc2ccccc2c2nnc(c3ccccc3)n12)C(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.911 |
| logD: | 3.8499 |
| logSw: | -4.1135 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.303 |
| InChI Key: | CTDUBYNDJGWUTB-UHFFFAOYSA-N |