BAS 02495983
TL;DR: BAS 02495983 (CAS 335406-10-5) is a chemical compound with molecular formula C21H25ClN2O5S and molecular weight 452.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: BAS 02495983, methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-{[(4-chloro-2-methylphenoxy)acetyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-(2-(4-chloro-2-methylphenoxy)acetamido)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-{[(4-chloro-2-methylphenoxy)acetyl]amino}-5-[(diethylamino)carbonyl]-4-methyl-3-thiophenecarboxylate
| Molecular Formula | C21H25ClN2O5S |
|---|---|
| Molecular Weight | 452.12 g/mol |
| LogP | 4.30444 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.11728 |
| Heavy Atoms | 30 |
| Complexity | 953.11365 |
Chemical Identifiers
| CAS Number | 335406-10-5 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)COC2=C(C=C(C=C2)Cl)C)C(=O)OC)C |
Product Overview
BAS 02495983 (CAS 335406-10-5), with molecular formula C21H25ClN2O5S and molecular weight 452.12 g/mol. IUPAC: methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02495983
Property Insights of BAS 02495983
The XLogP value of 4.30444 indicates that BAS 02495983 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02495983. Following Lipinski's Rule of Five, BAS 02495983 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02495983?
The CAS number of BAS 02495983 is 335406-10-5.
What is the molecular formula of BAS 02495983?
The molecular formula of BAS 02495983 is C21H25ClN2O5S.
What is the molecular weight of BAS 02495983?
The molecular weight of BAS 02495983 is 452.12 g/mol.
Where can I buy BAS 02495983?
You can request a quote for BAS 02495983 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02495983?
Yes, KEHONG BIO provides custom synthesis services for BAS 02495983 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.