BAS 00314877
TL;DR: BAS 00314877 (CAS 464923-32-8) is a chemical compound with molecular formula C17H16ClFN2OS and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-2-bicyclo[2.2.1]heptanylmethylideneamino]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide
Also Known As: BAS 00314877, N'-(bicyclo[2.2.1]hept-2-ylmethylene)-3-chloro-6-fluoro-1-benzothiophene-2-carbohydrazide, N'-[(E)-bicyclo[2.2.1]hept-2-ylmethylidene]-3-chloro-6-fluoro-1-benzothiophene-2-carbohydrazide, N-((1E)-2-bicyclo[2.2.1]hept-2-yl-1-azavinyl)(3-chloro-6-fluorobenzo[b]thiophe n-2-yl)carboxamide, N-[(E)-2-bicyclo[2.2.1]heptanylmethylideneamino]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide
| Molecular Formula | C17H16ClFN2OS |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 4.8456 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.06558 |
| Heavy Atoms | 23 |
| Complexity | 803.2324 |
Chemical Identifiers
| CAS Number | 464923-32-8 |
|---|---|
| SMILES | C1CC2CC1CC2/C=N/NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl |
Product Overview
BAS 00314877 (CAS 464923-32-8), with molecular formula C17H16ClFN2OS and molecular weight 350.07 g/mol. IUPAC: N-[(E)-2-bicyclo[2.2.1]heptanylmethylideneamino]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of BAS 00314877
Property Insights of BAS 00314877
The XLogP value of 4.8456 indicates that BAS 00314877 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.46 Ų, BAS 00314877 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00314877 has 1 hydrogen bond donor(s) and 3 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 00314877?
The CAS number of BAS 00314877 is 464923-32-8.
What is the molecular formula of BAS 00314877?
The molecular formula of BAS 00314877 is C17H16ClFN2OS.
What is the molecular weight of BAS 00314877?
The molecular weight of BAS 00314877 is 350.07 g/mol.
Where can I buy BAS 00314877?
You can request a quote for BAS 00314877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00314877?
Yes, KEHONG BIO provides custom synthesis services for BAS 00314877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.