[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V016-5833 |
| Compound Name: | [4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C25 H22 N6 O S |
| Smiles: | C1CN(CCN(C1)c1nc2ccccc2c2nnc(c3ccccc3)n12)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6072 |
| logD: | 4.546 |
| logSw: | -4.4275 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.799 |
| InChI Key: | BFYPDMYKHALURS-UHFFFAOYSA-N |