BAS 01023512
TL;DR: BAS 01023512 (CAS 333774-55-3) is a chemical compound with molecular formula C27H26N2O5S2 and molecular weight 522.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethyl-2-[[3-[(4-methylphenyl)sulfonylamino]naphthalene-2-carbonyl]amino]thiophene-3-carboxylate
Also Known As: BAS 01023512, A1969/0082785, ethyl 5-ethyl-2-(3-(4-methylphenylsulfonamido)-2-naphthamido)thiophene-3-carboxylate, ethyl 5-ethyl-2-[[3-[(4-methylphenyl)sulfonylamino]naphthalene-2-carbonyl]amino]thiophene-3-carboxylate, ETHYL 5-ETHYL-2-[3-(4-METHYLBENZENESULFONAMIDO)NAPHTHALENE-2-AMIDO]THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C27H26N2O5S2 |
|---|---|
| Molecular Weight | 522.13 g/mol |
| LogP | 6.00192 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 522.1283 |
| Heavy Atoms | 36 |
| Complexity | 1540.4387 |
Chemical Identifiers
| CAS Number | 333774-55-3 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=O)C2=CC3=CC=CC=C3C=C2NS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OCC |
Product Overview
BAS 01023512 (CAS 333774-55-3), with molecular formula C27H26N2O5S2 and molecular weight 522.13 g/mol. IUPAC: ethyl 5-ethyl-2-[[3-[(4-methylphenyl)sulfonylamino]naphthalene-2-carbonyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of BAS 01023512
Property Insights of BAS 01023512
The XLogP value of 6.00192 indicates that BAS 01023512 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01023512. Following Lipinski's Rule of Five, BAS 01023512 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01023512?
The CAS number of BAS 01023512 is 333774-55-3.
What is the molecular formula of BAS 01023512?
The molecular formula of BAS 01023512 is C27H26N2O5S2.
What is the molecular weight of BAS 01023512?
The molecular weight of BAS 01023512 is 522.13 g/mol.
Where can I buy BAS 01023512?
You can request a quote for BAS 01023512 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01023512?
Yes, KEHONG BIO provides custom synthesis services for BAS 01023512 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.