C25H24N4O5S
TL;DR: C25H24N4O5S (CAS 577761-60-5) is a chemical compound with molecular formula C25H24N4O5S and molecular weight 492.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-[(3,4-dimethoxyphenyl)methyl]-6-[(Z)-(3-methoxy-4-oxo-5-prop-2-enylcyclohexa-2,5-dien-1-ylidene)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (Z)-6-(3-allyl-4-hydroxy-5-methoxybenzylidene)-2-(3,4-dimethoxybenzyl)-5-imino-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C25H24N4O5S |
|---|---|
| Molecular Weight | 492.15 g/mol |
| LogP | 3.3401 |
| Topological Polar Surface Area | 118.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 492.14673 |
| Heavy Atoms | 35 |
| Complexity | 1478.979 |
Chemical Identifiers
| CAS Number | 577761-60-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NN3C(=C(C(=O)N=C3S2)/C=C\4/C=C(C(=O)C(=C4)OC)CC=C)N)OC |
Product Overview
C25H24N4O5S (CAS 577761-60-5), with molecular formula C25H24N4O5S and molecular weight 492.15 g/mol. IUPAC: 5-amino-2-[(3,4-dimethoxyphenyl)methyl]-6-[(Z)-(3-methoxy-4-oxo-5-prop-2-enylcyclohexa-2,5-dien-1-ylidene)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of C25H24N4O5S
Property Insights of C25H24N4O5S
The XLogP value of 3.3401 indicates that C25H24N4O5S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.04 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H24N4O5S. Following Lipinski's Rule of Five, C25H24N4O5S has 1 hydrogen bond donor(s) and 9 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 C25H24N4O5S?
The CAS number of C25H24N4O5S is 577761-60-5.
What is the molecular formula of C25H24N4O5S?
The molecular formula of C25H24N4O5S is C25H24N4O5S.
What is the molecular weight of C25H24N4O5S?
The molecular weight of C25H24N4O5S is 492.15 g/mol.
Where can I buy C25H24N4O5S?
You can request a quote for C25H24N4O5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H24N4O5S?
Yes, KEHONG BIO provides custom synthesis services for C25H24N4O5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.