C29H24N6O2S.2ClH
TL;DR: C29H24N6O2S.2ClH (CAS 66725-13-1) is a chemical compound with molecular formula C29H26Cl2N6O2S and molecular weight 592.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide;dihydrochloride
Also Known As: C29-H24-N6-O2-S.2Cl-H.1/2H2-O, Ethanesulfonanilide, 4'-(9-acridinylamino)-2-(4-quinazolinylamino)-, dihydrochloride, hemihydrate, N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride, N-{4-[(Acridin-9-yl)amino]phenyl}-2-[(quinazolin-4-yl)amino]ethane-1-sulfonamide--hydrogen chloride (1/2)
| Molecular Formula | C29H26Cl2N6O2S |
|---|---|
| Molecular Weight | 592.12 g/mol |
| LogP | 6.7722 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 592.1215 |
| Heavy Atoms | 40 |
| Complexity | 838.0 |
Chemical Identifiers
| CAS Number | 66725-13-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NS(=O)(=O)CCNC5=NC=NC6=CC=CC=C65.Cl.Cl |
| InChIKey | VUAZGOJGFUTRMT-UHFFFAOYSA-N |
Product Overview
C29H24N6O2S.2ClH (CAS 66725-13-1), with molecular formula C29H26Cl2N6O2S and molecular weight 592.12 g/mol. IUPAC: N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide;dihydrochloride.
Chemical Property Profile of C29H24N6O2S.2ClH
Property Insights of C29H24N6O2S.2ClH
The XLogP value of 6.7722 indicates that C29H24N6O2S.2ClH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C29H24N6O2S.2ClH. Following Lipinski's Rule of Five, C29H24N6O2S.2ClH has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C29H24N6O2S.2ClH?
The CAS number of C29H24N6O2S.2ClH is 66725-13-1.
What is the molecular formula of C29H24N6O2S.2ClH?
The molecular formula of C29H24N6O2S.2ClH is C29H26Cl2N6O2S.
What is the molecular weight of C29H24N6O2S.2ClH?
The molecular weight of C29H24N6O2S.2ClH is 592.12 g/mol.
Where can I buy C29H24N6O2S.2ClH?
You can request a quote for C29H24N6O2S.2ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C29H24N6O2S.2ClH?
Yes, KEHONG BIO provides custom synthesis services for C29H24N6O2S.2ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.