3-({[5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazol-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
3-({[5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazol-2-yl]sulfanyl}methyl)benzonitrile
3-({[5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazol-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V018-2752 |
| Compound Name: | 3-({[5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazol-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 456.58 |
| Molecular Formula: | C22 H24 N4 O3 S2 |
| Salt: | not_available |
| Smiles: | CCCn1c2ccc(cc2nc1SCc1cccc(C#N)c1)S(N1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9077 |
| logD: | 3.9052 |
| logSw: | -3.9488 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.403 |
| InChI Key: | KYCHLNVBRRYXTB-UHFFFAOYSA-N |