BAS 00486321
TL;DR: BAS 00486321 (CAS 329067-27-8) is a chemical compound with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(2-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
Also Known As: BAS 00486321, N-[3-[(2-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide, [2-(2-furylcarbonylamino)(4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)]-N-(2-methy lphenyl)carboxamide, N-{3-[(2-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
| Molecular Formula | C21H20N2O3S |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 5.03292 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.11948 |
| Heavy Atoms | 27 |
| Complexity | 989.03284 |
Chemical Identifiers
| CAS Number | 329067-27-8 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4 |
Product Overview
BAS 00486321 (CAS 329067-27-8), with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol. IUPAC: N-[3-[(2-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of BAS 00486321
Property Insights of BAS 00486321
The XLogP value of 5.03292 indicates that BAS 00486321 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00486321. Following Lipinski's Rule of Five, BAS 00486321 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00486321?
The CAS number of BAS 00486321 is 329067-27-8.
What is the molecular formula of BAS 00486321?
The molecular formula of BAS 00486321 is C21H20N2O3S.
What is the molecular weight of BAS 00486321?
The molecular weight of BAS 00486321 is 380.12 g/mol.
Where can I buy BAS 00486321?
You can request a quote for BAS 00486321 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00486321?
Yes, KEHONG BIO provides custom synthesis services for BAS 00486321 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.