VU0611498-1
TL;DR: VU0611498-1 (CAS 900893-44-9) is a chemical compound with molecular formula C27H22N4O4 and molecular weight 466.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-6-benzyl-12-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: VU0611498-1, F3345-0016, N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-benzyl-12-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaene-5-carboxamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-1-benzyl-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
| Molecular Formula | C27H22N4O4 |
|---|---|
| Molecular Weight | 466.16 g/mol |
| LogP | 3.66462 |
| Topological Polar Surface Area | 86.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.1641 |
| Heavy Atoms | 35 |
| Complexity | 1653.4993 |
Chemical Identifiers
| CAS Number | 900893-44-9 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(N3CC4=CC=CC=C4)C(=O)NCC5=CC6=C(C=C5)OCO6)C=C1 |
Product Overview
VU0611498-1 (CAS 900893-44-9), with molecular formula C27H22N4O4 and molecular weight 466.16 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-6-benzyl-12-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide.
Chemical Property Profile of VU0611498-1
Property Insights of VU0611498-1
The XLogP value of 3.66462 indicates that VU0611498-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.86 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0611498-1. Following Lipinski's Rule of Five, VU0611498-1 has 1 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 VU0611498-1?
The CAS number of VU0611498-1 is 900893-44-9.
What is the molecular formula of VU0611498-1?
The molecular formula of VU0611498-1 is C27H22N4O4.
What is the molecular weight of VU0611498-1?
The molecular weight of VU0611498-1 is 466.16 g/mol.
Where can I buy VU0611498-1?
You can request a quote for VU0611498-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0611498-1?
Yes, KEHONG BIO provides custom synthesis services for VU0611498-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.