C23H16ClN5S
TL;DR: C23H16ClN5S (CAS 877778-75-1) is a chemical compound with molecular formula C23H16ClN5S and molecular weight 429.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2-chloro-6-methylquinolin-3-yl)methylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine
Also Known As: (E)-4-(2-((2-chloro-6-methylquinolin-3-yl)methylene)hydrazinyl)-5-phenylthieno[2,3-d]pyrimidine, 2-chloro-6-methyl-3-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}quinoline
| Molecular Formula | C23H16ClN5S |
|---|---|
| Molecular Weight | 429.08 g/mol |
| LogP | 6.31432 |
| Topological Polar Surface Area | 63.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.08148 |
| Heavy Atoms | 30 |
| Complexity | 1395.4419 |
Chemical Identifiers
| CAS Number | 877778-75-1 |
|---|---|
| SMILES | CC1=CC2=CC(=C(N=C2C=C1)Cl)/C=N/NC3=C4C(=CSC4=NC=N3)C5=CC=CC=C5 |
Product Overview
C23H16ClN5S (CAS 877778-75-1), with molecular formula C23H16ClN5S and molecular weight 429.08 g/mol. IUPAC: N-[(E)-(2-chloro-6-methylquinolin-3-yl)methylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of C23H16ClN5S
Property Insights of C23H16ClN5S
The XLogP value of 6.31432 indicates that C23H16ClN5S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.06 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H16ClN5S. Following Lipinski's Rule of Five, C23H16ClN5S has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C23H16ClN5S?
The CAS number of C23H16ClN5S is 877778-75-1.
What is the molecular formula of C23H16ClN5S?
The molecular formula of C23H16ClN5S is C23H16ClN5S.
What is the molecular weight of C23H16ClN5S?
The molecular weight of C23H16ClN5S is 429.08 g/mol.
Where can I buy C23H16ClN5S?
You can request a quote for C23H16ClN5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H16ClN5S?
Yes, KEHONG BIO provides custom synthesis services for C23H16ClN5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.