VU0180393-3
TL;DR: VU0180393-3 (CAS 899411-75-7) is a chemical compound with molecular formula C22H23ClN6 and molecular weight 406.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(3-chlorophenyl)piperazin-1-yl]-4,11,13-trimethyl-3,7,8,10-tetrazatricyclo[7.4.0.02,7]trideca-1,3,5,8,10,12-hexaene
Also Known As: VU0180393-3, 4-(4-(3-chlorophenyl)piperazin-1-yl)-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine, 6-[4-(3-chlorophenyl)piperazin-1-yl]-4,11,13-trimethyl-3,7,8,10-tetraazatricyclo[7.4.0.0^{2,7}]trideca-1,3,5,8,10,12-hexaene, 4-[4-(3-chlorophenyl)piperazin-1-yl]-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine, 4-[4-(3-chlorophenyl)piperazinyl]-2,8,10-trimethyl-5-hydropyrimidino[1',2'-1,5 ]pyrazolo[3,4-b]pyridine
| Molecular Formula | C22H23ClN6 |
|---|---|
| Molecular Weight | 406.17 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 406.16727 |
| Heavy Atoms | 29 |
| Complexity | 570.0 |
Chemical Identifiers
| CAS Number | 899411-75-7 |
|---|---|
| SMILES | CC1=CC(=NC2=NN3C(=CC(=NC3=C12)C)N4CCN(CC4)C5=CC(=CC=C5)Cl)C |
| InChIKey | SWSYYWCGHRYKEU-UHFFFAOYSA-N |
Product Overview
VU0180393-3 (CAS 899411-75-7), with molecular formula C22H23ClN6 and molecular weight 406.17 g/mol. IUPAC: 6-[4-(3-chlorophenyl)piperazin-1-yl]-4,11,13-trimethyl-3,7,8,10-tetrazatricyclo[7.4.0.02,7]trideca-1,3,5,8,10,12-hexaene.
Chemical Property Profile of VU0180393-3
Property Insights of VU0180393-3
The XLogP value of 4.8 indicates that VU0180393-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.6 Ų, VU0180393-3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0180393-3 has 0 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 VU0180393-3?
The CAS number of VU0180393-3 is 899411-75-7.
What is the molecular formula of VU0180393-3?
The molecular formula of VU0180393-3 is C22H23ClN6.
What is the molecular weight of VU0180393-3?
The molecular weight of VU0180393-3 is 406.17 g/mol.
Where can I buy VU0180393-3?
You can request a quote for VU0180393-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0180393-3?
Yes, KEHONG BIO provides custom synthesis services for VU0180393-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.