TL;DR: 7H-527S (CAS 344274-60-8) is a chemical compound with molecular formula C24H21Cl2N3S2 and molecular weight 485.0554 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2,4-dichlorophenyl)methylsulfanylmethyl]-5-[(4-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole
Also Known As: 7H-527S, 3-{[(2,4-dichlorobenzyl)sulfanyl]methyl}-5-[(4-methylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole, 3-({[(2,4-dichlorophenyl)methyl]sulfanyl}methyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole, 3-[(2,4-dichlorophenyl)methylsulfanylmethyl]-5-[(4-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole
| Molecular Formula | C24H21Cl2N3S2 |
| Molecular Weight | 485.0554 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 81.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 485.0554 Da |
| Heavy Atoms | 31 |
| Complexity | 529.0 |
| SMILES | CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CSCC4=C(C=C(C=C4)Cl)Cl |
| InChIKey | QCIUCXARCPZTBG-UHFFFAOYSA-N |
The XLogP value of 7.0 indicates that 7H-527S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 7H-527S. Following Lipinski's Rule of Five, 7H-527S has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 7H-527S is 344274-60-8.
The molecular formula of 7H-527S is C24H21Cl2N3S2.
The molecular weight of 7H-527S is 485.0554 g/mol.
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