BAS 02495926
TL;DR: BAS 02495926 (CAS 335405-88-4) is a chemical compound with molecular formula C26H30N2O4S and molecular weight 466.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(adamantane-1-carbonylamino)-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate
Also Known As: BAS 02495926, Methyl 2-(adamantane-1-carboxamido)-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylate, Methyl2-(adamantane-1-carboxamido)-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylate, 2-[(Adamantane-1-carbonyl)-amino]-4-methyl-5-m-tolylcarbamoyl-thiophene-3-carboxylic acid methyl ester, methyl 2-(adamantane-1-carbonylamino)-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate
| Molecular Formula | C26H30N2O4S |
|---|---|
| Molecular Weight | 466.19 g/mol |
| LogP | 5.55874 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.19263 |
| Heavy Atoms | 33 |
| Complexity | 1100.0226 |
Chemical Identifiers
| CAS Number | 335405-88-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)OC)C |
Product Overview
BAS 02495926 (CAS 335405-88-4), with molecular formula C26H30N2O4S and molecular weight 466.19 g/mol. IUPAC: methyl 2-(adamantane-1-carbonylamino)-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate.
Chemical Property Profile of BAS 02495926
Property Insights of BAS 02495926
The XLogP value of 5.55874 indicates that BAS 02495926 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 BAS 02495926. Following Lipinski's Rule of Five, BAS 02495926 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 BAS 02495926?
The CAS number of BAS 02495926 is 335405-88-4.
What is the molecular formula of BAS 02495926?
The molecular formula of BAS 02495926 is C26H30N2O4S.
What is the molecular weight of BAS 02495926?
The molecular weight of BAS 02495926 is 466.19 g/mol.
Where can I buy BAS 02495926?
You can request a quote for BAS 02495926 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02495926?
Yes, KEHONG BIO provides custom synthesis services for BAS 02495926 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.