N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(3-phenylpropyl)urea
Chemical Structure Depiction of
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(3-phenylpropyl)urea
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(3-phenylpropyl)urea
Compound characteristics
| Compound ID: | C791-0717 |
| Compound Name: | N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(3-phenylpropyl)urea |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C26 H27 N3 O2 S |
| Smiles: | Cc1ccc(CN2C(CSc3ccc(cc23)NC(NCCCc2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8057 |
| logD: | 5.8057 |
| logSw: | -5.3006 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.085 |
| InChI Key: | QTHQPJJTPAZMRZ-UHFFFAOYSA-N |