8-chloro-3-methyl-5-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
8-chloro-3-methyl-5-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
8-chloro-3-methyl-5-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V018-6825 |
| Compound Name: | 8-chloro-3-methyl-5-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 456.95 |
| Molecular Formula: | C21 H21 Cl N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)S(N1CCN(CC1)c1nc2cc(ccc2c2nnc(C)n12)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.873 |
| logD: | 3.7191 |
| logSw: | -4.1917 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.561 |
| InChI Key: | HDSBDPJJTXZDQD-UHFFFAOYSA-N |