3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-8726 |
| Compound Name: | 3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H23 N5 O3 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CCN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.305 |
| logD: | 2.3047 |
| logSw: | -2.7327 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.108 |
| InChI Key: | GGYFMQCSQCOGJM-UHFFFAOYSA-N |