RefChem:814477
TL;DR: RefChem:814477 (CAS 618074-92-3) is a chemical compound with molecular formula C17H18N4O4 and molecular weight 342.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-imino-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: Methyl 2-imino-1-(2-methoxyethyl)-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, METHYL 2-IMINO-1-(2-METHOXYETHYL)-10-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXYLATE, 637-921-8, METHYL 2-IMINO-1-(2-METHOXYETHYL)-10-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO(1,2-A:2,3-D)PYRIMIDINE-3-CARBOXYLATE, Methyl2-imino-1-(2-methoxyethyl)-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
| Molecular Formula | C17H18N4O4 |
|---|---|
| Molecular Weight | 342.13 g/mol |
| LogP | 0.87009 |
| Topological Polar Surface Area | 98.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.1328 |
| Heavy Atoms | 25 |
| Complexity | 1097.6704 |
Chemical Identifiers
| CAS Number | 618074-92-3 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCOC)C(=O)OC |
Product Overview
RefChem:814477 (CAS 618074-92-3), with molecular formula C17H18N4O4 and molecular weight 342.13 g/mol. IUPAC: methyl 6-imino-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of RefChem:814477
Property Insights of RefChem:814477
The XLogP value of 0.87009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:814477. The TPSA of 98.68 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:814477. Following Lipinski's Rule of Five, RefChem:814477 has 1 hydrogen bond donor(s) and 6 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 RefChem:814477?
The CAS number of RefChem:814477 is 618074-92-3.
What is the molecular formula of RefChem:814477?
The molecular formula of RefChem:814477 is C17H18N4O4.
What is the molecular weight of RefChem:814477?
The molecular weight of RefChem:814477 is 342.13 g/mol.
Where can I buy RefChem:814477?
You can request a quote for RefChem:814477 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:814477?
Yes, KEHONG BIO provides custom synthesis services for RefChem:814477 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.