TL;DR: YU7M7DHG46 (CAS 151648-34-9) is a chemical compound with molecular formula C13H19N5O2S and molecular weight 309.12595 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-ethylsulfonylphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
Also Known As: 1-(4-ethylsulfonylphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine, 1,3,5-Triazine-2,4-diamine, 1-(4-(ethylsulfonyl)phenyl)-1,6-dihydro-6,6-dimethyl-, 1,3,5-Triazine-2,4-diamine, 1-[4-(ethylsulfonyl)phenyl]-1,6-dihydro-6,6-dimethyl-, 1-[4-(Ethanesulfonyl)phenyl]-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine, 1-[4-(Ethylsulfonyl)phenyl]-1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamine
| Molecular Formula | C13H19N5O2S |
| Molecular Weight | 309.12595 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.12595 Da |
| Heavy Atoms | 21 |
| Complexity | 554.0 |
| SMILES | CCS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=NC2(C)C)N)N |
| InChIKey | NQZRQFQJBBBTGR-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for YU7M7DHG46. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for YU7M7DHG46. Following Lipinski's Rule of Five, YU7M7DHG46 has 2 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 YU7M7DHG46 is 151648-34-9.
The molecular formula of YU7M7DHG46 is C13H19N5O2S.
The molecular weight of YU7M7DHG46 is 309.12595 g/mol.
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