2-methyl-N-{3-[3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamido]phenyl}propanamide
Chemical Structure Depiction of
2-methyl-N-{3-[3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamido]phenyl}propanamide
2-methyl-N-{3-[3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamido]phenyl}propanamide
Compound characteristics
| Compound ID: | 5983-5299 |
| Compound Name: | 2-methyl-N-{3-[3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamido]phenyl}propanamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C20 H21 N3 O5 S |
| Smiles: | CC(C)C(Nc1cccc(c1)NC(CCN1C(c2ccccc2S1(=O)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.643 |
| logD: | 1.643 |
| logSw: | -2.7603 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.674 |
| InChI Key: | UPVBCQBQAFJBKI-UHFFFAOYSA-N |