BAS 12946001
TL;DR: BAS 12946001 (CAS 1093407-96-5) is a chemical compound with molecular formula C20H27NO8 and molecular weight 409.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethoxyphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: BAS 12946001, VU0509398-1, VU0509398-2, F3114-0039, N-(2,4-dimethoxyphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecane-8-carboxamide
| Molecular Formula | C20H27NO8 |
|---|---|
| Molecular Weight | 409.17 g/mol |
| LogP | 2.0388 |
| Topological Polar Surface Area | 93.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.17368 |
| Heavy Atoms | 29 |
| Complexity | 794.6859 |
Chemical Identifiers
| CAS Number | 1093407-96-5 |
|---|---|
| SMILES | CC1(OC2C(O1)C(OC3C2OC(O3)(C)C)C(=O)NC4=C(C=C(C=C4)OC)OC)C |
Product Overview
BAS 12946001 (CAS 1093407-96-5), with molecular formula C20H27NO8 and molecular weight 409.17 g/mol. IUPAC: N-(2,4-dimethoxyphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide.
Chemical Property Profile of BAS 12946001
Property Insights of BAS 12946001
The XLogP value of 2.0388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12946001. The TPSA of 93.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12946001. Following Lipinski's Rule of Five, BAS 12946001 has 1 hydrogen bond donor(s) and 8 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 12946001?
The CAS number of BAS 12946001 is 1093407-96-5.
What is the molecular formula of BAS 12946001?
The molecular formula of BAS 12946001 is C20H27NO8.
What is the molecular weight of BAS 12946001?
The molecular weight of BAS 12946001 is 409.17 g/mol.
Where can I buy BAS 12946001?
You can request a quote for BAS 12946001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12946001?
Yes, KEHONG BIO provides custom synthesis services for BAS 12946001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.