BAS 00447946
TL;DR: BAS 00447946 (CAS 467239-59-4) is a chemical compound with molecular formula C43H33NO7 and molecular weight 675.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[8,9-bis(4-methoxyphenyl)-3,5,10-trioxo-1,7-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]benzoate
Also Known As: BAS 00447946, methyl 4-[8,9-bis(4-methoxyphenyl)-3,5,10-trioxo-1,7-diphenyl-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl]benzoate, methyl 4-(5,6-bis(4-methoxyphenyl)-1,3,8-trioxo-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindol-2(3H)-yl)benzoate, methyl 4-[8,9-bis(4-methoxyphenyl)-3,5,10-trioxo-1,7-diphenyl-4-azatricyclo[5. 2.1.0<2,6>]dec-8-en-4-yl]benzoate, methyl 4-[8,9-bis(4-methoxyphenyl)-3,5,10-trioxo-1,7-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]benzoate
| Molecular Formula | C43H33NO7 |
|---|---|
| Molecular Weight | 675.23 g/mol |
| LogP | 6.6793 |
| Topological Polar Surface Area | 99.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 675.2257 |
| Heavy Atoms | 51 |
| Complexity | 2099.6936 |
Chemical Identifiers
| CAS Number | 467239-59-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C3(C4C(C2(C3=O)C5=CC=CC=C5)C(=O)N(C4=O)C6=CC=C(C=C6)C(=O)OC)C7=CC=CC=C7)C8=CC=C(C=C8)OC |
Product Overview
BAS 00447946 (CAS 467239-59-4), with molecular formula C43H33NO7 and molecular weight 675.23 g/mol. IUPAC: methyl 4-[8,9-bis(4-methoxyphenyl)-3,5,10-trioxo-1,7-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]benzoate.
Chemical Property Profile of BAS 00447946
Property Insights of BAS 00447946
The XLogP value of 6.6793 indicates that BAS 00447946 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00447946. Following Lipinski's Rule of Five, BAS 00447946 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00447946?
The CAS number of BAS 00447946 is 467239-59-4.
What is the molecular formula of BAS 00447946?
The molecular formula of BAS 00447946 is C43H33NO7.
What is the molecular weight of BAS 00447946?
The molecular weight of BAS 00447946 is 675.23 g/mol.
Where can I buy BAS 00447946?
You can request a quote for BAS 00447946 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00447946?
Yes, KEHONG BIO provides custom synthesis services for BAS 00447946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.