RefChem:565115
TL;DR: RefChem:565115 (CAS 56532-67-3) is a chemical compound with molecular formula C27H22ClN3O4 and molecular weight 487.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(3-butoxypropyl)-6-chloro-3,10,17-triazahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2,4(9),5,7,12,14,19(23),20-nonaene-11,16,18-trione
Also Known As: 2-(3-butoxypropyl)-10-chlorobenzimidazo[2,1-b]benzo[lmn][3,8]phenanthroline-1,3,6(2h)-trione, 2-(3-Butoxypropyl)-10-chlorobenzimidazo(2,1-b)benzo(lmn)(3,8)phenanthroline-1,3,6(2H)-trione, Benzimidazo(2,1-b)benzo(lmn)(3,8)phenanthroline-1,3,6(2H)-trione, 2-(3-butoxypropyl)-9(or 10)-chloro-, 17-(3-butoxypropyl)-6-chloro-3,10,17-triazahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(21),2,4,6,8,12,14,19,22-nonaene-11,16,18-trione, 2-(3-Butoxypropyl)-10-chloro[1,3]benzimidazo[2,1-b]benzo[lmn][3,8]phenanthroline-1,3,6(2H)-trione
| Molecular Formula | C27H22ClN3O4 |
|---|---|
| Molecular Weight | 487.13 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.12988 |
| Heavy Atoms | 35 |
| Complexity | 869.0 |
Chemical Identifiers
| CAS Number | 56532-67-3 |
|---|---|
| SMILES | CCCCOCCCN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=NC6=C(N5C4=O)C=CC(=C6)Cl)C1=O |
| InChIKey | FMOOUOXPMHKXAV-UHFFFAOYSA-N |
Product Overview
RefChem:565115 (CAS 56532-67-3), with molecular formula C27H22ClN3O4 and molecular weight 487.13 g/mol. IUPAC: 17-(3-butoxypropyl)-6-chloro-3,10,17-triazahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2,4(9),5,7,12,14,19(23),20-nonaene-11,16,18-trione.
Chemical Property Profile of RefChem:565115
Property Insights of RefChem:565115
The XLogP value of 5.0 indicates that RefChem:565115 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:565115. Following Lipinski's Rule of Five, RefChem:565115 has 0 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:565115?
The CAS number of RefChem:565115 is 56532-67-3.
What is the molecular formula of RefChem:565115?
The molecular formula of RefChem:565115 is C27H22ClN3O4.
What is the molecular weight of RefChem:565115?
The molecular weight of RefChem:565115 is 487.13 g/mol.
Where can I buy RefChem:565115?
You can request a quote for RefChem:565115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:565115?
Yes, KEHONG BIO provides custom synthesis services for RefChem:565115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.