BAS 00486653
TL;DR: BAS 00486653 (CAS 328261-59-2) is a chemical compound with molecular formula C22H22N2O3S2 and molecular weight 426.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-6-methyl-2-(thiophene-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BAS 00486653, N-(2-methoxyphenyl)-6-methyl-2-(thiophene-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-(2-methoxyphenyl)-6-methyl-2-[(thiophen-2-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-(2-methoxyphenyl)-6-methyl-2-[(2-thienylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-(2-methoxyphenyl)[6-methyl-2-(2-thienylcarbonylamino)(4,5,6,7-tetrahydrobenz o[b]thiophen-3-yl)]carboxamide
| Molecular Formula | C22H22N2O3S2 |
|---|---|
| Molecular Weight | 426.11 g/mol |
| LogP | 5.4476 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.10718 |
| Heavy Atoms | 29 |
| Complexity | 1040.5171 |
Chemical Identifiers
| CAS Number | 328261-59-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3OC)NC(=O)C4=CC=CS4 |
Product Overview
BAS 00486653 (CAS 328261-59-2), with molecular formula C22H22N2O3S2 and molecular weight 426.11 g/mol. IUPAC: N-(2-methoxyphenyl)-6-methyl-2-(thiophene-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BAS 00486653
Property Insights of BAS 00486653
The XLogP value of 5.4476 indicates that BAS 00486653 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00486653. Following Lipinski's Rule of Five, BAS 00486653 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 00486653?
The CAS number of BAS 00486653 is 328261-59-2.
What is the molecular formula of BAS 00486653?
The molecular formula of BAS 00486653 is C22H22N2O3S2.
What is the molecular weight of BAS 00486653?
The molecular weight of BAS 00486653 is 426.11 g/mol.
Where can I buy BAS 00486653?
You can request a quote for BAS 00486653 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00486653?
Yes, KEHONG BIO provides custom synthesis services for BAS 00486653 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.