N-[5-(diethylamino)pentan-2-yl]-2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]acetamide
Chemical Structure Depiction of
N-[5-(diethylamino)pentan-2-yl]-2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]acetamide
N-[5-(diethylamino)pentan-2-yl]-2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]acetamide
Compound characteristics
| Compound ID: | V011-0410 |
| Compound Name: | N-[5-(diethylamino)pentan-2-yl]-2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]acetamide |
| Molecular Weight: | 401.57 |
| Molecular Formula: | C22 H31 N3 O2 S |
| Salt: | not_available |
| Smiles: | CCN(CC)CCCC(C)NC(\C=C1/C(N(CC=C)c2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8088 |
| logD: | 0.6732 |
| logSw: | -3.7682 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.915 |
| InChI Key: | ROJOWKNMBPZKHH-KRWDZBQOSA-N |