VU0113300-2
TL;DR: VU0113300-2 (CAS 422283-45-2) is a chemical compound with molecular formula C22H23ClN4O2S and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methyl]-4-oxo-N-(2-pyrrolidin-1-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: VU0113300-2, F3168-1759, 3-[(4-chlorophenyl)methyl]-4-oxo-N-(2-pyrrolidin-1-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide, 3-(4-chlorobenzyl)-4-oxo-N-(2-(pyrrolidin-1-yl)ethyl)-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide, 3-(4-chlorobenzyl)-4-oxo-N-(2-pyrrolidin-1-ylethyl)-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
| Molecular Formula | C22H23ClN4O2S |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | 3.58639 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.12302 |
| Heavy Atoms | 30 |
| Complexity | 1180.4471 |
Chemical Identifiers
| CAS Number | 422283-45-2 |
|---|---|
| SMILES | C1CCN(C1)CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4=CC=C(C=C4)Cl |
Product Overview
VU0113300-2 (CAS 422283-45-2), with molecular formula C22H23ClN4O2S and molecular weight 442.12 g/mol. IUPAC: 3-[(4-chlorophenyl)methyl]-4-oxo-N-(2-pyrrolidin-1-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide.
Chemical Property Profile of VU0113300-2
Property Insights of VU0113300-2
The XLogP value of 3.58639 indicates that VU0113300-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0113300-2. Following Lipinski's Rule of Five, VU0113300-2 has 2 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 VU0113300-2?
The CAS number of VU0113300-2 is 422283-45-2.
What is the molecular formula of VU0113300-2?
The molecular formula of VU0113300-2 is C22H23ClN4O2S.
What is the molecular weight of VU0113300-2?
The molecular weight of VU0113300-2 is 442.12 g/mol.
Where can I buy VU0113300-2?
You can request a quote for VU0113300-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0113300-2?
Yes, KEHONG BIO provides custom synthesis services for VU0113300-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.