3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-5827 |
| Compound Name: | 3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 383.84 |
| Molecular Formula: | C19 H18 Cl N5 O2 |
| Smiles: | C1CN(CCN1C(CN1C(c2ccccc2N=N1)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7374 |
| logD: | 2.7374 |
| logSw: | -3.7117 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.585 |
| InChI Key: | IPGKHHRVZSAQAW-UHFFFAOYSA-N |