VU0507981-1
TL;DR: VU0507981-1 (CAS 1212432-97-7) is a chemical compound with molecular formula C19H22BrNO4 and molecular weight 407.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-bromo-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carbonyl)amino]benzoate
Also Known As: VU0507981-1, methyl 2-{[(2-bromo-4,7,7-trimethyl-3-oxobicyclo[2.2.1]hept-1-yl)carbonyl]amino}benzoate, F3055-0095, AF-399/42177034, methyl o-(3-bromo-2-oxo-4-bornanylcarbonylamino)benzoate
| Molecular Formula | C19H22BrNO4 |
|---|---|
| Molecular Weight | 407.07 g/mol |
| LogP | 3.5706 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.0732 |
| Heavy Atoms | 25 |
| Complexity | 774.4425 |
Chemical Identifiers
| CAS Number | 1212432-97-7 |
|---|---|
| SMILES | CC1(C2(CCC1(C(C2=O)Br)C(=O)NC3=CC=CC=C3C(=O)OC)C)C |
Product Overview
VU0507981-1 (CAS 1212432-97-7), with molecular formula C19H22BrNO4 and molecular weight 407.07 g/mol. IUPAC: methyl 2-[(2-bromo-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carbonyl)amino]benzoate.
Chemical Property Profile of VU0507981-1
Property Insights of VU0507981-1
The XLogP value of 3.5706 indicates that VU0507981-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0507981-1. Following Lipinski's Rule of Five, VU0507981-1 has 1 hydrogen bond donor(s) and 4 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 VU0507981-1?
The CAS number of VU0507981-1 is 1212432-97-7.
What is the molecular formula of VU0507981-1?
The molecular formula of VU0507981-1 is C19H22BrNO4.
What is the molecular weight of VU0507981-1?
The molecular weight of VU0507981-1 is 407.07 g/mol.
Where can I buy VU0507981-1?
You can request a quote for VU0507981-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0507981-1?
Yes, KEHONG BIO provides custom synthesis services for VU0507981-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.