3-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
3-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | K906-2931 |
| Compound Name: | 3-{2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(pyrrolidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)C(CN1C(=O)Oc2cc(ccc12)S(N1CCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8327 |
| logD: | 2.8313 |
| logSw: | -3.4979 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.015 |
| InChI Key: | HPRKIZHJZNSYQV-IBGZPJMESA-N |