VU0512567-1
TL;DR: VU0512567-1 (CAS 422287-74-9) is a chemical compound with molecular formula C18H24BrN3O3S and molecular weight 441.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-propan-2-yloxypropyl)butanamide
Also Known As: VU0512567-1, 4-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-propan-2-yloxypropyl)butanamide, F3168-1826, 4-(6-bromo-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)-N-(3-isopropoxypropyl)butanamide, 4-(6-bromo-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)-N-[3-(propan-2-yloxy)propyl]butanamide
| Molecular Formula | C18H24BrN3O3S |
|---|---|
| Molecular Weight | 441.07 g/mol |
| LogP | 3.53309 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 441.07217 |
| Heavy Atoms | 26 |
| Complexity | 876.0909 |
Chemical Identifiers
| CAS Number | 422287-74-9 |
|---|---|
| SMILES | CC(C)OCCCNC(=O)CCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=S |
Product Overview
VU0512567-1 (CAS 422287-74-9), with molecular formula C18H24BrN3O3S and molecular weight 441.07 g/mol. IUPAC: 4-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-propan-2-yloxypropyl)butanamide.
Chemical Property Profile of VU0512567-1
Property Insights of VU0512567-1
The XLogP value of 3.53309 indicates that VU0512567-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0512567-1. Following Lipinski's Rule of Five, VU0512567-1 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 VU0512567-1?
The CAS number of VU0512567-1 is 422287-74-9.
What is the molecular formula of VU0512567-1?
The molecular formula of VU0512567-1 is C18H24BrN3O3S.
What is the molecular weight of VU0512567-1?
The molecular weight of VU0512567-1 is 441.07 g/mol.
Where can I buy VU0512567-1?
You can request a quote for VU0512567-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0512567-1?
Yes, KEHONG BIO provides custom synthesis services for VU0512567-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.