CTK8D8832
TL;DR: CTK8D8832 (CAS 30768-50-4) is a chemical compound with molecular formula C20H24N6O4 and molecular weight 412.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[5-amino-7-(ethoxycarbonylamino)-1,2-dihydropyrido[3,4-b]pyrazin-3-yl]methyl-methylamino]benzoate
Also Known As: Methyl 4-(((5-amino-7-((ethoxycarbonyl)amino)-1,2-dihydropyrido(3,4-b)pyrazin-3-yl)methyl)methylamino)benzoate, methyl 4-[({5-amino-7-[(ethoxycarbonyl)amino]-1,2-dihydropyrido[3,4-b]pyrazin-3-yl}methyl)(methyl)amino]benzoate, Pyrido(3,4-b)pyrazine-7-carbamic acid, 5-amino-3-((p-carboxy-N-methylanilino)methyl)-1,2-dihydro-, 7-ethyl methyl ester, 7-Ethyl methyl 5-amino-3-((p-carboxy-N-methylanilino)methyl)-1,2-dihydropyrido(3,4-b)pyrazine-7-carbamate, BENZOIC ACID, 4-(((5-AMINO-7-((ETHOXYCARBONYL)AMINO)-1,2-DIHYDROPYRIDO(3,4-B)PYRAZIN-3-YL)METHYL)METHYLAMINO)-, METHYL ESTER
| Molecular Formula | C20H24N6O4 |
|---|---|
| Molecular Weight | 412.19 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.1859 |
| Heavy Atoms | 30 |
| Complexity | 637.0 |
Chemical Identifiers
| CAS Number | 30768-50-4 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C2C(=C1)NCC(=N2)CN(C)C3=CC=C(C=C3)C(=O)OC)N |
| InChIKey | XBHLDPLKLQVISW-UHFFFAOYSA-N |
Product Overview
CTK8D8832 (CAS 30768-50-4), with molecular formula C20H24N6O4 and molecular weight 412.19 g/mol. IUPAC: methyl 4-[[5-amino-7-(ethoxycarbonylamino)-1,2-dihydropyrido[3,4-b]pyrazin-3-yl]methyl-methylamino]benzoate.
Chemical Property Profile of CTK8D8832
Property Insights of CTK8D8832
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8D8832. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8D8832. Following Lipinski's Rule of Five, CTK8D8832 has 3 hydrogen bond donor(s) and 9 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 CTK8D8832?
The CAS number of CTK8D8832 is 30768-50-4.
What is the molecular formula of CTK8D8832?
The molecular formula of CTK8D8832 is C20H24N6O4.
What is the molecular weight of CTK8D8832?
The molecular weight of CTK8D8832 is 412.19 g/mol.
Where can I buy CTK8D8832?
You can request a quote for CTK8D8832 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8D8832?
Yes, KEHONG BIO provides custom synthesis services for CTK8D8832 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.