TL;DR: Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide (CAS 1025338-80-0) is a chemical compound with molecular formula C25H22Cl2N4O3 and molecular weight 496.1069 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3,4-dichlorophenyl)carbamoylamino]-3-(1H-indol-3-yl)-N-(4-methoxyphenyl)propanamide
Also Known As: 2-[(3,4-dichlorophenyl)carbamoylamino]-3-(1H-indol-3-yl)-N-(4-methoxyphenyl)propanamide, Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide, 2-(3-(3,4-dichlorophenyl)ureido)-3-(1H-indol-3-yl)-N-(4-methoxyphenyl)propanamide
| Molecular Formula | C25H22Cl2N4O3 |
| Molecular Weight | 496.1069 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 95.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.1069 Da |
| Heavy Atoms | 34 |
| Complexity | 691.0 |
| SMILES | COC1=CC=C(C=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)NC4=CC(=C(C=C4)Cl)Cl |
| InChIKey | UXDISIIPODHQET-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide. Following Lipinski's Rule of Five, Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide is 1025338-80-0.
The molecular formula of Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide is C25H22Cl2N4O3.
The molecular weight of Nalpha-[(3,4-dichlorophenyl)carbamoyl]-N-(4-methoxyphenyl)tryptophanamide is 496.1069 g/mol.
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