BAS 06731088
TL;DR: BAS 06731088 (CAS 1008068-85-6) is a chemical compound with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(2,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Also Known As: BAS 06731088, methyl 1-(2,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate, methyl 1-(2,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 1-(2,4-Dimethoxy-phenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid, methyl 1-(2,4-dimethoxyphenyl)-1,2,3,4-tetrahydrobeta-carboline-3-carboxylate
| Molecular Formula | C21H22N2O4 |
|---|---|
| Molecular Weight | 366.16 g/mol |
| LogP | 2.9618 |
| Topological Polar Surface Area | 72.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.15796 |
| Heavy Atoms | 27 |
| Complexity | 995.0103 |
Chemical Identifiers
| CAS Number | 1008068-85-6 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2C3=C(CC(N2)C(=O)OC)C4=CC=CC=C4N3)OC |
Product Overview
BAS 06731088 (CAS 1008068-85-6), with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol. IUPAC: methyl 1-(2,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate.
Chemical Property Profile of BAS 06731088
Property Insights of BAS 06731088
The XLogP value of 2.9618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06731088. The TPSA of 72.58 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06731088. Following Lipinski's Rule of Five, BAS 06731088 has 2 hydrogen bond donor(s) and 5 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 06731088?
The CAS number of BAS 06731088 is 1008068-85-6.
What is the molecular formula of BAS 06731088?
The molecular formula of BAS 06731088 is C21H22N2O4.
What is the molecular weight of BAS 06731088?
The molecular weight of BAS 06731088 is 366.16 g/mol.
Where can I buy BAS 06731088?
You can request a quote for BAS 06731088 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06731088?
Yes, KEHONG BIO provides custom synthesis services for BAS 06731088 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.