BRD-A56842498-001-01-2
TL;DR: BRD-A56842498-001-01-2 (CAS 1044283-97-7) is a chemical compound with molecular formula C20H17ClN4O2S and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chlorophenyl)methyl]-3-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide
Also Known As: BRD-A56842498-001-01-2, F6548-3613, N-[(3-chlorophenyl)methyl]-3-{3-oxo-5-sulfanylidene-2H,3H,5H,6H-imidazo[1,2-c]quinazolin-2-yl}propanamide, N-[(3-chlorophenyl)methyl]-3-(3-oxo-5-sulfanylidene-2,6-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide
| Molecular Formula | C20H17ClN4O2S |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 3.95009 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.07608 |
| Heavy Atoms | 28 |
| Complexity | 1144.499 |
Chemical Identifiers
| CAS Number | 1044283-97-7 |
|---|---|
| SMILES | C1=CC2=C3NC(C(=O)N3C(=S)N=C2C=C1)CCC(=O)NCC4=CC(=CC=C4)Cl |
Product Overview
BRD-A56842498-001-01-2 (CAS 1044283-97-7), with molecular formula C20H17ClN4O2S and molecular weight 412.08 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-3-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide.
Chemical Property Profile of BRD-A56842498-001-01-2
Property Insights of BRD-A56842498-001-01-2
The XLogP value of 3.95009 indicates that BRD-A56842498-001-01-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A56842498-001-01-2. Following Lipinski's Rule of Five, BRD-A56842498-001-01-2 has 2 hydrogen bond donor(s) and 5 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 BRD-A56842498-001-01-2?
The CAS number of BRD-A56842498-001-01-2 is 1044283-97-7.
What is the molecular formula of BRD-A56842498-001-01-2?
The molecular formula of BRD-A56842498-001-01-2 is C20H17ClN4O2S.
What is the molecular weight of BRD-A56842498-001-01-2?
The molecular weight of BRD-A56842498-001-01-2 is 412.08 g/mol.
Where can I buy BRD-A56842498-001-01-2?
You can request a quote for BRD-A56842498-001-01-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-A56842498-001-01-2?
Yes, KEHONG BIO provides custom synthesis services for BRD-A56842498-001-01-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.