4-bromo-N-(4-{1-[(2-methoxyethyl)carbamoyl]cyclopropyl}phenyl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-bromo-N-(4-{1-[(2-methoxyethyl)carbamoyl]cyclopropyl}phenyl)benzamide--trifluoroacetic acid (1/1)
4-bromo-N-(4-{1-[(2-methoxyethyl)carbamoyl]cyclopropyl}phenyl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L165-0474 |
| Compound Name: | 4-bromo-N-(4-{1-[(2-methoxyethyl)carbamoyl]cyclopropyl}phenyl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 531.32 |
| Molecular Formula: | C20 H21 Br N2 O3 |
| Salt: | CF3COOH |
| Smiles: | COCCNC(C1(CC1)c1ccc(cc1)NC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.271 |
| logD: | 3.2706 |
| logSw: | -3.4566 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.45 |
| InChI Key: | VTWOGKXVJXYWHO-UHFFFAOYSA-N |