TL;DR: 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- (CAS 111535-30-9) is a chemical compound with molecular formula C14H18ClN5 and molecular weight 291.12506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-4-N-ethyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
Also Known As: 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)-, 6-chloro-4-N-ethyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine, 6-Chloro-N~2~-ethyl-N~4~-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine, 6-CHLORO-N2-ETHYL-N4-(2-PHENYLPROPAN-2-YL)-1,3,5-TRIAZINE-2,4-DIAMINE, N-(alpha,alpha-Dimethylbenzyl)-N -ethyl-6-chloro-1,3,5-triazine-2,4-diamine
| Molecular Formula | C14H18ClN5 |
| Molecular Weight | 291.12506 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 62.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.12506 Da |
| Heavy Atoms | 20 |
| Complexity | 293.0 |
| SMILES | CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C2=CC=CC=C2 |
| InChIKey | HZIRWGPXXMEAPB-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)-. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- is 111535-30-9.
The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- is C14H18ClN5.
The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-chloro-N-ethyl-N'-(1-methyl-1-phenylethyl)- is 291.12506 g/mol.
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