RefChem:422161
TL;DR: RefChem:422161 (CAS 510760-87-9) is a chemical compound with molecular formula C26H23N5O3 and molecular weight 453.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(furan-2-ylmethyl)-6-imino-13-methyl-2-oxo-N-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: BAS 04995366, 1-(Furan-2-ylmethyl)-2-imino-8-methyl-5-oxo-N-phenethyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE, 1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO(1,2-A:2,3-D)PYRIMIDINE-3-CARBOXAMIDE, 1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-N-(2-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2',3'-D]PYRIMIDINE-3-CARBOXAMIDE
| Molecular Formula | C26H23N5O3 |
|---|---|
| Molecular Weight | 453.18 g/mol |
| LogP | 3.05089 |
| Topological Polar Surface Area | 105.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.18008 |
| Heavy Atoms | 34 |
| Complexity | 1616.4633 |
Chemical Identifiers
| CAS Number | 510760-87-9 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(C(=N)N3CC4=CC=CO4)C(=O)NCCC5=CC=CC=C5)C=C1 |
Product Overview
RefChem:422161 (CAS 510760-87-9), with molecular formula C26H23N5O3 and molecular weight 453.18 g/mol. IUPAC: 7-(furan-2-ylmethyl)-6-imino-13-methyl-2-oxo-N-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of RefChem:422161
Property Insights of RefChem:422161
The XLogP value of 3.05089 indicates that RefChem:422161 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.39 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:422161. Following Lipinski's Rule of Five, RefChem:422161 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 RefChem:422161?
The CAS number of RefChem:422161 is 510760-87-9.
What is the molecular formula of RefChem:422161?
The molecular formula of RefChem:422161 is C26H23N5O3.
What is the molecular weight of RefChem:422161?
The molecular weight of RefChem:422161 is 453.18 g/mol.
Where can I buy RefChem:422161?
You can request a quote for RefChem:422161 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:422161?
Yes, KEHONG BIO provides custom synthesis services for RefChem:422161 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.