ethyl 4-({3-[(2-methylpropyl)carbamoyl]-4-(pyrrolidin-1-yl)phenyl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 4-({3-[(2-methylpropyl)carbamoyl]-4-(pyrrolidin-1-yl)phenyl}carbamamido)benzoate
ethyl 4-({3-[(2-methylpropyl)carbamoyl]-4-(pyrrolidin-1-yl)phenyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | V028-6403 |
| Compound Name: | ethyl 4-({3-[(2-methylpropyl)carbamoyl]-4-(pyrrolidin-1-yl)phenyl}carbamamido)benzoate |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C25 H32 N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc(cc1)NC(Nc1ccc(c(c1)C(NCC(C)C)=O)N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5414 |
| logD: | 5.5414 |
| logSw: | -5.3533 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.497 |
| InChI Key: | CIJSZVUBCGNNKK-UHFFFAOYSA-N |