2-{4-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-ol
Chemical Structure Depiction of
2-{4-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-ol
2-{4-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-ol
Compound characteristics
| Compound ID: | 8016-9893 |
| Compound Name: | 2-{4-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzene-1-sulfonyl]piperazin-1-yl}ethan-1-ol |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C23 H26 N6 O3 S |
| Smiles: | Cc1ccc(cc1S(N1CCN(CC1)CCO)(=O)=O)c1c2ccccc2c2nnc(C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 1.7015 |
| logD: | 1.6904 |
| logSw: | -2.3872 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.376 |
| InChI Key: | YPZSHIURJOTAPW-UHFFFAOYSA-N |