N-(4-methoxyphenyl)-4-[4-(3-methylbutanamido)-2-(pyrrolidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-4-[4-(3-methylbutanamido)-2-(pyrrolidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
N-(4-methoxyphenyl)-4-[4-(3-methylbutanamido)-2-(pyrrolidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V012-8924 |
| Compound Name: | N-(4-methoxyphenyl)-4-[4-(3-methylbutanamido)-2-(pyrrolidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 521.66 |
| Molecular Formula: | C29 H39 N5 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(c1)C(N1CCCC1)=O)N1CCCN(CC1)C(Nc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2926 |
| logD: | 4.2886 |
| logSw: | -4.2426 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.705 |
| InChI Key: | YWYLWAILCNZXMG-UHFFFAOYSA-N |