8-chloro-5-{4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl}-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
8-chloro-5-{4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl}-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazoline
8-chloro-5-{4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl}-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V019-7253 |
| Compound Name: | 8-chloro-5-{4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl}-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 479 |
| Molecular Formula: | C24 H23 Cl N6 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN2CCCN(CC2)c2nc3cc(ccc3c3nnc(c4cccs4)n23)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.4917 |
| logD: | 4.2714 |
| logSw: | -6.0278 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.146 |
| InChI Key: | GBQIXWJMIPVYQW-UHFFFAOYSA-N |