[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](cyclopentyl)methanone
Chemical Structure Depiction of
[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](cyclopentyl)methanone
[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](cyclopentyl)methanone
Compound characteristics
| Compound ID: | V015-7182 |
| Compound Name: | [4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](cyclopentyl)methanone |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C27 H29 Cl N6 O |
| Salt: | not_available |
| Smiles: | C1CCC(C1)C(N1CCCN(CC1)c1nc2cc(ccc2c2nnc(Cc3ccccc3)n12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3375 |
| logD: | 5.3211 |
| logSw: | -5.9538 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.315 |
| InChI Key: | DATWJUVCXBGVEJ-UHFFFAOYSA-N |