RefChem:825426
TL;DR: RefChem:825426 (CAS 488110-73-2) is a chemical compound with molecular formula C21H21N5O3 and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: BAS 04995776, N-(2-FURYLMETHYL)-2-IMINO-10-METHYL-5-OXO-1-PROPYL-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE, N-(Furan-2-ylmethyl)-2-imino-10-methyl-5-oxo-1-propyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 638-725-5, N-(2-FURYLMETHYL)-2-IMINO-10-METHYL-5-OXO-1-PROPYL-1,5-DIHYDRO-2H-DIPYRIDO(1,2-A:2,3-D)PYRIMIDINE-3-CARBOXAMIDE
| Molecular Formula | C21H21N5O3 |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 2.37009 |
| Topological Polar Surface Area | 105.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.16443 |
| Heavy Atoms | 29 |
| Complexity | 1332.6854 |
Chemical Identifiers
| CAS Number | 488110-73-2 |
|---|---|
| SMILES | CCCN1C2=C(C=C(C1=N)C(=O)NCC3=CC=CO3)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
RefChem:825426 (CAS 488110-73-2), with molecular formula C21H21N5O3 and molecular weight 391.16 g/mol. IUPAC: N-(furan-2-ylmethyl)-6-imino-11-methyl-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of RefChem:825426
Property Insights of RefChem:825426
The XLogP value of 2.37009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:825426. The TPSA of 105.39 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:825426. Following Lipinski's Rule of Five, RefChem:825426 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:825426?
The CAS number of RefChem:825426 is 488110-73-2.
What is the molecular formula of RefChem:825426?
The molecular formula of RefChem:825426 is C21H21N5O3.
What is the molecular weight of RefChem:825426?
The molecular weight of RefChem:825426 is 391.16 g/mol.
Where can I buy RefChem:825426?
You can request a quote for RefChem:825426 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825426?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825426 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.