TL;DR: BAS 03072928 (CAS 1094164-31-4) is a chemical compound with molecular formula C29H29N5O3 and molecular weight 495.22705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzamido-N-[1-(3-imidazol-1-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
Also Known As: BAS 03072928, 2-benzamido-N-[1-(3-imidazol-1-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]benzamide, 2-Benzoylamino-N-[1-(3-imidazol-1-yl-propylcarbamoyl)-2-phenyl-ethyl]-benzamide, N-(1-((3-(1H-imidazol-1-yl)propyl)amino)-1-oxo-3-phenylpropan-2-yl)-2-benzamidobenzamide, N-[3-(1H-imidazol-1-yl)propyl]-Nalpha-({2-[(phenylcarbonyl)amino]phenyl}carbonyl)phenylalaninamide
| Molecular Formula | C29H29N5O3 |
| Molecular Weight | 495.22705 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 495.22705 Da |
| Heavy Atoms | 37 |
| Complexity | 735.0 |
| SMILES | C1=CC=C(C=C1)CC(C(=O)NCCCN2C=CN=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4 |
| InChIKey | CTXLGUVDOXLXRA-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that BAS 03072928 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03072928. Following Lipinski's Rule of Five, BAS 03072928 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 03072928 is 1094164-31-4.
The molecular formula of BAS 03072928 is C29H29N5O3.
The molecular weight of BAS 03072928 is 495.22705 g/mol.
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