RefChem:547089
TL;DR: RefChem:547089 (CAS 65355-52-4) is a chemical compound with molecular formula C24H21N5O and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
18-(diethylamino)-12-imino-15-oxa-3,11-diazapentacyclo[12.8.0.02,11.04,9.016,21]docosa-1(22),2,4,6,8,13,16(21),17,19-nonaene-13-carbonitrile
Also Known As: 7H,9H-(1)Benzopyrano(3',2':3,4)pyrido(2,1-b)quinazoline-6-carbonitrile, 3-(diethylamino)-7-imino-, 7H,9H-[1]Benzopyrano[3',2':3,4]pyrido[2,1-b]quinazoline-6-carbonitrile, 3-(diethylamino)-7-imino-, (7e)-3-(diethylamino)-7-imino-7h,9h-chromeno[3',2':3,4]pyrido[2,1-b]quinazoline-6-carbonitrile, 3-(DIETHYLAMINO)-7-IMINO-7,9-DIHYDRO-5-OXA-8,14-DIAZAPENTAPHENE-6-CARBONITRILE, 3-(Diethylamino)-7-imino-7H,9H-[1]benzopyrano[3 ,2 :3,4]pyrido[2,1-b]quinazoline-6-carbonitrile
| Molecular Formula | C24H21N5O |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.17462 |
| Heavy Atoms | 30 |
| Complexity | 873.0 |
Chemical Identifiers
| CAS Number | 65355-52-4 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C3C(=C(C(=N)N4C3=NC5=CC=CC=C5C4)C#N)O2 |
| InChIKey | WQVJCOFEBPWBFJ-UHFFFAOYSA-N |
Product Overview
RefChem:547089 (CAS 65355-52-4), with molecular formula C24H21N5O and molecular weight 395.17 g/mol. IUPAC: 18-(diethylamino)-12-imino-15-oxa-3,11-diazapentacyclo[12.8.0.02,11.04,9.016,21]docosa-1(22),2,4,6,8,13,16(21),17,19-nonaene-13-carbonitrile.
Chemical Property Profile of RefChem:547089
Property Insights of RefChem:547089
The XLogP value of 3.3 indicates that RefChem:547089 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:547089. Following Lipinski's Rule of Five, RefChem:547089 has 1 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 RefChem:547089?
The CAS number of RefChem:547089 is 65355-52-4.
What is the molecular formula of RefChem:547089?
The molecular formula of RefChem:547089 is C24H21N5O.
What is the molecular weight of RefChem:547089?
The molecular weight of RefChem:547089 is 395.17 g/mol.
Where can I buy RefChem:547089?
You can request a quote for RefChem:547089 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:547089?
Yes, KEHONG BIO provides custom synthesis services for RefChem:547089 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.