4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N,N-diethylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N,N-diethylbenzene-1-sulfonamide
4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N,N-diethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D628-0045 |
| Compound Name: | 4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N,N-diethylbenzene-1-sulfonamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CCN(CC)S(c1ccc(cc1)C(N1CCCC1c1nc2ccccc2s1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7118 |
| logD: | 3.7118 |
| logSw: | -3.8618 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.492 |
| InChI Key: | SSKMUTDRADPPQS-IBGZPJMESA-N |