3,3-dimethyl-1-({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)butan-2-one
Chemical Structure Depiction of
3,3-dimethyl-1-({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)butan-2-one
3,3-dimethyl-1-({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)butan-2-one
Compound characteristics
| Compound ID: | V010-5718 |
| Compound Name: | 3,3-dimethyl-1-({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)butan-2-one |
| Molecular Weight: | 524.7 |
| Molecular Formula: | C24 H36 N4 O5 S2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(CSc1nc2cc(ccc2n1CCCN1CCOCC1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7932 |
| logD: | 2.6482 |
| logSw: | -3.2417 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 75.485 |
| InChI Key: | IKALTMKUKIGXSB-UHFFFAOYSA-N |