VU0003242-1
TL;DR: VU0003242-1 (CAS 560101-00-0) is a chemical compound with molecular formula C23H23NO5S and molecular weight 425.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-[(2-oxochromene-3-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: VU0003242-1, propyl 2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, propyl 2-[(2-oxochromene-3-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, propyl 2-(2-oxo-2H-chromene-3-carboxamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, propyl 2-[(2-oxochromen-3-yl)carbonylamino]-4,5,6,7,8-pentahydrocyclohepta[1,2 -b]thiophene-3-carboxylate
| Molecular Formula | C23H23NO5S |
|---|---|
| Molecular Weight | 425.13 g/mol |
| LogP | 4.9425 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.1297 |
| Heavy Atoms | 30 |
| Complexity | 1160.1001 |
Chemical Identifiers
| CAS Number | 560101-00-0 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC4=CC=CC=C4OC3=O |
Product Overview
VU0003242-1 (CAS 560101-00-0), with molecular formula C23H23NO5S and molecular weight 425.13 g/mol. IUPAC: propyl 2-[(2-oxochromene-3-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of VU0003242-1
Property Insights of VU0003242-1
The XLogP value of 4.9425 indicates that VU0003242-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0003242-1. Following Lipinski's Rule of Five, VU0003242-1 has 1 hydrogen bond donor(s) and 6 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 VU0003242-1?
The CAS number of VU0003242-1 is 560101-00-0.
What is the molecular formula of VU0003242-1?
The molecular formula of VU0003242-1 is C23H23NO5S.
What is the molecular weight of VU0003242-1?
The molecular weight of VU0003242-1 is 425.13 g/mol.
Where can I buy VU0003242-1?
You can request a quote for VU0003242-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0003242-1?
Yes, KEHONG BIO provides custom synthesis services for VU0003242-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.