3-methyl-6-{4-[3-(2-phenoxyethyl)pyrrolidine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-{4-[3-(2-phenoxyethyl)pyrrolidine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
3-methyl-6-{4-[3-(2-phenoxyethyl)pyrrolidine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S544-1029 |
| Compound Name: | 3-methyl-6-{4-[3-(2-phenoxyethyl)pyrrolidine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 513.61 |
| Molecular Formula: | C26 H31 N3 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)C(N1CCC(CCOc2ccccc2)C1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3003 |
| logD: | 3.3003 |
| logSw: | -3.9539 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.909 |
| InChI Key: | DQZIYDNRGUMTPR-IBGZPJMESA-N |