TL;DR: (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE (CAS 1024312-90-0) is a chemical compound with molecular formula C27H26BrNO5S and molecular weight 555.07153 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(1-bromonaphthalen-2-yl)oxymethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzenesulfonamide
Also Known As: (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE, 4-[(1-bromonaphthalen-2-yl)oxymethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzenesulfonamide, 4-[(1-bromo-2-naphthyl)oxymethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzenesulfonamide, 4-{[(1-bromonaphthalen-2-yl)oxy]methyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzene-1-sulfonamide, C27H26BrNO5S
| Molecular Formula | C27H26BrNO5S |
| Molecular Weight | 555.07153 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 82.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 555.07153 Da |
| Heavy Atoms | 35 |
| Complexity | 738.0 |
| SMILES | COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)COC3=C(C4=CC=CC=C4C=C3)Br)OC |
| InChIKey | DIOCPUBVWQLMJY-UHFFFAOYSA-N |
The XLogP value of 6.2 indicates that (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE. Following Lipinski's Rule of Five, (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE is 1024312-90-0.
The molecular formula of (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE is C27H26BrNO5S.
The molecular weight of (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-((1-BROMO(2-NAPHTHYLOXY))METHYL)PHENYL)SULFONYL)AMINE is 555.07153 g/mol.
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