CR 631
4-bromo-N-[3-[4-[2-(diethylamino)ethoxy]phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]benzamide
| Molecular Formula | C28H40BrN3O3 |
|---|---|
| Molecular Weight | 546.5 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 61.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 545.2253 |
| Heavy Atoms | 35 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 57228-19-0 |
|---|---|
| SMILES | CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN(CC)CC)NC(=O)C2=CC=C(C=C2)Br |
| InChIKey | YLDQIABNRZYWAP-UHFFFAOYSA-N |
📖 Product Overview
CR 631 (CAS: 57228-19-0) is a chemical compound with molecular formula C28H40BrN3O3 and molecular weight 546.5 g/mol. Its IUPAC systematic name is 4-bromo-N-[3-[4-[2-(diethylamino)ethoxy]phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]benzamide.
YLDQIABNRZYWAP-UHFFFAOYSA-N.
SMILES: CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN(CC)CC)NC(=O)C2=CC=C(C=C2)Br.
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