BRD-A72489301-001-01-9
TL;DR: BRD-A72489301-001-01-9 (CAS 1041071-25-3) is a chemical compound with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide
Also Known As: BRD-A72489301-001-01-9, N-butyl-3-{5-[(cyanomethyl)sulfanyl]-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-2-yl}propanamide, F0921-6711, N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide, N-butyl-3-{5-[(cyanomethyl)thio]-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-2-yl}propanamide
| Molecular Formula | C19H21N5O2S |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 2.59838 |
| Topological Polar Surface Area | 97.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.1416 |
| Heavy Atoms | 27 |
| Complexity | 842.74695 |
Chemical Identifiers
| CAS Number | 1041071-25-3 |
|---|---|
| SMILES | CCCCNC(=O)CCC1C(=O)N2C(=N1)C3=CC=CC=C3N=C2SCC#N |
Product Overview
BRD-A72489301-001-01-9 (CAS 1041071-25-3), with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol. IUPAC: N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide.
Chemical Property Profile of BRD-A72489301-001-01-9
Property Insights of BRD-A72489301-001-01-9
The XLogP value of 2.59838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRD-A72489301-001-01-9. The TPSA of 97.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A72489301-001-01-9. Following Lipinski's Rule of Five, BRD-A72489301-001-01-9 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 BRD-A72489301-001-01-9?
The CAS number of BRD-A72489301-001-01-9 is 1041071-25-3.
What is the molecular formula of BRD-A72489301-001-01-9?
The molecular formula of BRD-A72489301-001-01-9 is C19H21N5O2S.
What is the molecular weight of BRD-A72489301-001-01-9?
The molecular weight of BRD-A72489301-001-01-9 is 383.14 g/mol.
Where can I buy BRD-A72489301-001-01-9?
You can request a quote for BRD-A72489301-001-01-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-A72489301-001-01-9?
Yes, KEHONG BIO provides custom synthesis services for BRD-A72489301-001-01-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.