VU0611587-1
TL;DR: VU0611587-1 (CAS 896596-36-4) is a chemical compound with molecular formula C22H22N4O2 and molecular weight 374.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-10-methyl-2-oxo-N-propan-2-yl-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: VU0611587-1, F3345-0364, 1-benzyl-N-isopropyl-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, 6-benzyl-10-methyl-2-oxo-N-(propan-2-yl)-1,6,8-triazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaene-5-carboxamide, 1-benzyl-9-methyl-4-oxo-N-(propan-2-yl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
| Molecular Formula | C22H22N4O2 |
|---|---|
| Molecular Weight | 374.17 g/mol |
| LogP | 3.14412 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.1743 |
| Heavy Atoms | 28 |
| Complexity | 1236.3502 |
Chemical Identifiers
| CAS Number | 896596-36-4 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(N3CC4=CC=CC=C4)C(=O)NC(C)C |
Product Overview
VU0611587-1 (CAS 896596-36-4), with molecular formula C22H22N4O2 and molecular weight 374.17 g/mol. IUPAC: 6-benzyl-10-methyl-2-oxo-N-propan-2-yl-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide.
Chemical Property Profile of VU0611587-1
Property Insights of VU0611587-1
The XLogP value of 3.14412 indicates that VU0611587-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0611587-1. Following Lipinski's Rule of Five, VU0611587-1 has 1 hydrogen bond donor(s) and 3 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 VU0611587-1?
The CAS number of VU0611587-1 is 896596-36-4.
What is the molecular formula of VU0611587-1?
The molecular formula of VU0611587-1 is C22H22N4O2.
What is the molecular weight of VU0611587-1?
The molecular weight of VU0611587-1 is 374.17 g/mol.
Where can I buy VU0611587-1?
You can request a quote for VU0611587-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0611587-1?
Yes, KEHONG BIO provides custom synthesis services for VU0611587-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.