[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl](thiophen-3-yl)methanone
[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | T404-1048 |
| Compound Name: | [4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 361.85 |
| Molecular Formula: | C16 H16 Cl N5 O S |
| Smiles: | C1CN(CCN(C1)c1nnc2ccc(cn12)[Cl])C(c1ccsc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4905 |
| logD: | 2.4905 |
| logSw: | -2.9419 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.54 |
| InChI Key: | SWJWVKSXIULOEK-UHFFFAOYSA-N |