CBKinase1_000480
TL;DR: CBKinase1_000480 (CAS 303013-98-1) is a chemical compound with molecular formula C23H23BrN2O3S and molecular weight 486.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one
Also Known As: CBKinase1_000480, CBKinase1_012880, BAS 00718748, AB00094819-01, BRD-A74673465-001-01-8
| Molecular Formula | C23H23BrN2O3S |
|---|---|
| Molecular Weight | 486.06 g/mol |
| LogP | 5.2641 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.06128 |
| Heavy Atoms | 30 |
| Complexity | 1141.3885 |
Chemical Identifiers
| CAS Number | 303013-98-1 |
|---|---|
| SMILES | CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Br)C |
Product Overview
CBKinase1_000480 (CAS 303013-98-1), with molecular formula C23H23BrN2O3S and molecular weight 486.06 g/mol. IUPAC: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one.
Chemical Property Profile of CBKinase1_000480
Property Insights of CBKinase1_000480
The XLogP value of 5.2641 indicates that CBKinase1_000480 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_000480. Following Lipinski's Rule of Five, CBKinase1_000480 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_000480?
The CAS number of CBKinase1_000480 is 303013-98-1.
What is the molecular formula of CBKinase1_000480?
The molecular formula of CBKinase1_000480 is C23H23BrN2O3S.
What is the molecular weight of CBKinase1_000480?
The molecular weight of CBKinase1_000480 is 486.06 g/mol.
Where can I buy CBKinase1_000480?
You can request a quote for CBKinase1_000480 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_000480?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_000480 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.