VU0246980-4
TL;DR: VU0246980-4 (CAS 636989-22-5) is a chemical compound with molecular formula C25H21N5O3 and molecular weight 439.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(furan-2-ylmethyl)-6-imino-N-[(4-methylphenyl)methyl]-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: VU0246980-4, AO-022/42398843, 1-(furan-2-ylmethyl)-2-imino-N-(4-methylbenzyl)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 7-[(furan-2-yl)methyl]-6-imino-N-[(4-methylphenyl)methyl]-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide, 1-(2-furylmethyl)-2-imino-N-(4-methylbenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
| Molecular Formula | C25H21N5O3 |
|---|---|
| Molecular Weight | 439.16 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.16443 |
| Heavy Atoms | 33 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 636989-22-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(C2=N)CC5=CC=CO5 |
| InChIKey | QAPZABKXCNEDCM-UHFFFAOYSA-N |
Product Overview
VU0246980-4 (CAS 636989-22-5), with molecular formula C25H21N5O3 and molecular weight 439.16 g/mol. IUPAC: 7-(furan-2-ylmethyl)-6-imino-N-[(4-methylphenyl)methyl]-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of VU0246980-4
Property Insights of VU0246980-4
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0246980-4. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0246980-4. Following Lipinski's Rule of Five, VU0246980-4 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 VU0246980-4?
The CAS number of VU0246980-4 is 636989-22-5.
What is the molecular formula of VU0246980-4?
The molecular formula of VU0246980-4 is C25H21N5O3.
What is the molecular weight of VU0246980-4?
The molecular weight of VU0246980-4 is 439.16 g/mol.
Where can I buy VU0246980-4?
You can request a quote for VU0246980-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0246980-4?
Yes, KEHONG BIO provides custom synthesis services for VU0246980-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.