1-[7-(3,4-dihydroquinoline-1(2H)-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(3,4-dihydroquinoline-1(2H)-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
1-[7-(3,4-dihydroquinoline-1(2H)-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G269-0094 |
| Compound Name: | 1-[7-(3,4-dihydroquinoline-1(2H)-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one |
| Molecular Weight: | 402.53 |
| Molecular Formula: | C20 H22 N2 O3 S2 |
| Smiles: | CC(N1CCCSc2ccc(cc12)S(N1CCCc2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4403 |
| logD: | 3.4403 |
| logSw: | -3.9158 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.774 |
| InChI Key: | CZXQVZJRCZBQSB-UHFFFAOYSA-N |