1-[7-(4-ethylpiperazine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(4-ethylpiperazine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
1-[7-(4-ethylpiperazine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G269-0182 |
| Compound Name: | 1-[7-(4-ethylpiperazine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one |
| Molecular Weight: | 383.53 |
| Molecular Formula: | C17 H25 N3 O3 S2 |
| Smiles: | CCN1CCN(CC1)S(c1ccc2c(c1)N(CCCS2)C(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8888 |
| logD: | 1.802 |
| logSw: | -2.4799 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.869 |
| InChI Key: | OUZOKEJUCAJFOM-UHFFFAOYSA-N |