TL;DR: 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one (CAS 127531-85-5) is a chemical compound with molecular formula C17H21ClN8O and molecular weight 388.15268 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one
Also Known As: 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one, 1-(4,6-bis(dimethylamino)-1,3,5-triazin-2-yl)-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one, 1-(4,6-Bis-dimethylamino-[1,3,5]triazin-2-yl)-3-(4-chloro-phenyl)-2-imino-5-methyl-imidazolidin-4-one
| Molecular Formula | C17H21ClN8O |
| Molecular Weight | 388.15268 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 92.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.15268 Da |
| Heavy Atoms | 27 |
| Complexity | 549.0 |
| SMILES | CC1C(=O)N(C(=N)N1C2=NC(=NC(=N2)N(C)C)N(C)C)C3=CC=C(C=C3)Cl |
| InChIKey | QIKOYCLNVIQICL-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one. Following Lipinski's Rule of Five, 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one has 1 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 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one is 127531-85-5.
The molecular formula of 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one is C17H21ClN8O.
The molecular weight of 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one is 388.15268 g/mol.
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