2,4-Dimethyl-1-pentyl-benzol
TL;DR: 2,4-Dimethyl-1-pentyl-benzol (CAS 6050-43-7) is a chemical compound with molecular formula C22H25FN2O4S and molecular weight 432.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(cyclohexanecarbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Also Known As: 2,4-Dimethyl-1-pentyl-benzol, BIM-0042764.P001, ethyl 2-(cyclohexanecarbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate, ETHYL 2-(CYCLOHEXANECARBONYLAMINO)-5-[(2-FLUOROPHENYL)CARBAMOYL]-4-METHYL-THIOPHENE-3-CARBOXYLATE, ETHYL 2-CYCLOHEXANEAMIDO-5-[(2-FLUOROPHENYL)CARBAMOYL]-4-METHYLTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C22H25FN2O4S |
|---|---|
| Molecular Weight | 432.15 g/mol |
| LogP | 5.14342 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.15192 |
| Heavy Atoms | 30 |
| Complexity | 950.6093 |
Chemical Identifiers
| CAS Number | 6050-43-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C3CCCCC3 |
Product Overview
2,4-Dimethyl-1-pentyl-benzol (CAS 6050-43-7), with molecular formula C22H25FN2O4S and molecular weight 432.15 g/mol. IUPAC: ethyl 2-(cyclohexanecarbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of 2,4-Dimethyl-1-pentyl-benzol
Property Insights of 2,4-Dimethyl-1-pentyl-benzol
The XLogP value of 5.14342 indicates that 2,4-Dimethyl-1-pentyl-benzol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dimethyl-1-pentyl-benzol. Following Lipinski's Rule of Five, 2,4-Dimethyl-1-pentyl-benzol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-Dimethyl-1-pentyl-benzol?
The CAS number of 2,4-Dimethyl-1-pentyl-benzol is 6050-43-7.
What is the molecular formula of 2,4-Dimethyl-1-pentyl-benzol?
The molecular formula of 2,4-Dimethyl-1-pentyl-benzol is C22H25FN2O4S.
What is the molecular weight of 2,4-Dimethyl-1-pentyl-benzol?
The molecular weight of 2,4-Dimethyl-1-pentyl-benzol is 432.15 g/mol.
Where can I buy 2,4-Dimethyl-1-pentyl-benzol?
You can request a quote for 2,4-Dimethyl-1-pentyl-benzol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethyl-1-pentyl-benzol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethyl-1-pentyl-benzol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.