TL;DR: AN-329/41402704 (CAS 1212151-60-4) is a chemical compound with molecular formula C21H24N2O6S and molecular weight 432.1355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(1R,2S)-2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: AN-329/41402704, (1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid, (1R,2S)-2-({4-[(4-METHOXYPHENYL)SULFAMOYL]PHENYL}CARBAMOYL)CYCLOHEXANE-1-CARBOXYLIC ACID, (1R,2S)-2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid, rel-(1R,2S)-2-[[[4-[[(4-Methoxyphenyl)amino]sulfonyl]phenyl]amino]carbonyl]cyclohexanecarboxylic acid
| Molecular Formula | C21H24N2O6S |
| Molecular Weight | 432.1355 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.1355 Da |
| Heavy Atoms | 30 |
| Complexity | 691.0 |
| SMILES | COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CCCC[C@H]3C(=O)O |
| InChIKey | IHZNEGNAWUEPCJ-RBUKOAKNSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-329/41402704. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/41402704. Following Lipinski's Rule of Five, AN-329/41402704 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AN-329/41402704 is 1212151-60-4.
The molecular formula of AN-329/41402704 is C21H24N2O6S.
The molecular weight of AN-329/41402704 is 432.1355 g/mol.
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