BAS 11358064
TL;DR: BAS 11358064 (CAS 876892-92-1) is a chemical compound with molecular formula C18H13N3O5S and molecular weight 383.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-hydroxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-(5-nitrofuran-2-yl)methanone
Also Known As: BAS 11358064, F3008-0060, 2-[1-(5-nitrofuran-2-carbonyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]phenol, [3-(2-hydroxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-(5-nitrofuran-2-yl)methanone, [5-(o-hydroxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl](5-nitro-2-furyl)methanone
| Molecular Formula | C18H13N3O5S |
|---|---|
| Molecular Weight | 383.06 g/mol |
| LogP | 3.9464 |
| Topological Polar Surface Area | 109.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.0576 |
| Heavy Atoms | 27 |
| Complexity | 1040.9666 |
Chemical Identifiers
| CAS Number | 876892-92-1 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CS2)C(=O)C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4O |
Product Overview
BAS 11358064 (CAS 876892-92-1), with molecular formula C18H13N3O5S and molecular weight 383.06 g/mol. IUPAC: [3-(2-hydroxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-(5-nitrofuran-2-yl)methanone.
Chemical Property Profile of BAS 11358064
Property Insights of BAS 11358064
The XLogP value of 3.9464 indicates that BAS 11358064 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11358064. Following Lipinski's Rule of Five, BAS 11358064 has 1 hydrogen bond donor(s) and 7 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 11358064?
The CAS number of BAS 11358064 is 876892-92-1.
What is the molecular formula of BAS 11358064?
The molecular formula of BAS 11358064 is C18H13N3O5S.
What is the molecular weight of BAS 11358064?
The molecular weight of BAS 11358064 is 383.06 g/mol.
Where can I buy BAS 11358064?
You can request a quote for BAS 11358064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11358064?
Yes, KEHONG BIO provides custom synthesis services for BAS 11358064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.