TL;DR: Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. (CAS 119252-80-1) is a chemical compound with molecular formula C13H12Cl2N2O and molecular weight 282.03265 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-6-[(4-amino-3-chlorophenyl)methyl]-2-chlorophenol
Also Known As: Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv., 3-amino-6-[(4-amino-3-chlorophenyl)methyl]-2-chlorophenol
| Molecular Formula | C13H12Cl2N2O |
| Molecular Weight | 282.03265 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 72.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.03265 Da |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
| SMILES | C1=CC(=C(C=C1CC2=C(C(=C(C=C2)N)Cl)O)Cl)N |
| InChIKey | YIRRBNHKIAMQTO-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv.. Following Lipinski's Rule of Five, Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. has 3 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 Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. is 119252-80-1.
The molecular formula of Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. is C13H12Cl2N2O.
The molecular weight of Benzenamine, 4,4'-methylenebis(2-chloro-, monohydroxy deriv. is 282.03265 g/mol.
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