4-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | F510-0538 |
| Compound Name: | 4-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C23 H31 N3 O3 S |
| Smiles: | CCN(CC)C(c1ccc2c(c1)N(CC(NCCC1CCCCC=1)=O)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0801 |
| logD: | 2.0801 |
| logSw: | -2.8596 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.056 |
| InChI Key: | ZZPMZZGUEHUDFX-UHFFFAOYSA-N |