8-(cyclopropanecarbonyl)-1-(1H-indole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-1-(1H-indole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
8-(cyclopropanecarbonyl)-1-(1H-indole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0322 |
| Compound Name: | 8-(cyclopropanecarbonyl)-1-(1H-indole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | C1CN(CCNC(CC(c2ccccc2)N(C1)C(C1CC1)=O)=O)C(c1cc2ccccc2[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0433 |
| logD: | 3.0433 |
| logSw: | -3.4404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.992 |
| InChI Key: | WFWLSFPVOSYRDZ-DEOSSOPVSA-N |