3-{2-[4-(methanesulfonyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{2-[4-(methanesulfonyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
3-{2-[4-(methanesulfonyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-5831 |
| Compound Name: | 3-{2-[4-(methanesulfonyl)piperazin-1-yl]-2-oxoethyl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 351.38 |
| Molecular Formula: | C14 H17 N5 O4 S |
| Smiles: | CS(N1CCN(CC1)C(CN1C(c2ccccc2N=N1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2363 |
| logD: | -0.2363 |
| logSw: | -2.3615 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.608 |
| InChI Key: | KCNOFDGTVURQLC-UHFFFAOYSA-N |