N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | Y042-3571 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C21 H21 N3 O5 S2 |
| Smiles: | COc1ccccc1CN1CC(CC1=O)C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7659 |
| logD: | 1.7649 |
| logSw: | -2.7392 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.666 |
| InChI Key: | ASSJOGLGMNWGDQ-AWEZNQCLSA-N |