N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}cyclopentanecarboxamide
Chemical Structure Depiction of
N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}cyclopentanecarboxamide
N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V013-9058 |
| Compound Name: | N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}cyclopentanecarboxamide |
| Molecular Weight: | 449.64 |
| Molecular Formula: | C28 H39 N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(Cc1ccccc1)Cc1cc(ccc1N(C)C)NC(C1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7114 |
| logD: | 5.7091 |
| logSw: | -5.3004 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.075 |
| InChI Key: | YRIHTLYQQYBTQH-UHFFFAOYSA-N |