2-[({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
Chemical Structure Depiction of
2-[({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
2-[({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
Compound characteristics
Compound ID: | V003-0505 |
Compound Name: | 2-[({5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile |
Molecular Weight: | 541.69 |
Molecular Formula: | C26 H31 N5 O4 S2 |
Salt: | not_available |
Smiles: | C(CN1CCOCC1)Cn1c2ccc(cc2nc1SCc1ccccc1C#N)S(N1CCOCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0694 |
logD: | 2.9245 |
logSw: | -3.4473 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 79.023 |
InChI Key: | XMLZNOZWNANJCL-UHFFFAOYSA-N |