A3773/0160089
TL;DR: A3773/0160089 (CAS 727677-20-5) is a chemical compound with molecular formula C15H17ClN4OS and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Also Known As: A3773/0160089, 1-(4-chlorophenyl)-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one, 1-(4-chlorophenyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one, 1-(4-chlorophenyl)-6-propyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
| Molecular Formula | C15H17ClN4OS |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 3.14349 |
| Topological Polar Surface Area | 53.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.08115 |
| Heavy Atoms | 22 |
| Complexity | 796.6702 |
Chemical Identifiers
| CAS Number | 727677-20-5 |
|---|---|
| SMILES | CCCN1CC2=C(NC1)N(C(=S)NC2=O)C3=CC=C(C=C3)Cl |
Product Overview
A3773/0160089 (CAS 727677-20-5), with molecular formula C15H17ClN4OS and molecular weight 336.08 g/mol. IUPAC: 1-(4-chlorophenyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one.
Chemical Property Profile of A3773/0160089
Property Insights of A3773/0160089
The XLogP value of 3.14349 indicates that A3773/0160089 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.06 Ų, A3773/0160089 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3773/0160089 has 2 hydrogen bond donor(s) and 4 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 A3773/0160089?
The CAS number of A3773/0160089 is 727677-20-5.
What is the molecular formula of A3773/0160089?
The molecular formula of A3773/0160089 is C15H17ClN4OS.
What is the molecular weight of A3773/0160089?
The molecular weight of A3773/0160089 is 336.08 g/mol.
Where can I buy A3773/0160089?
You can request a quote for A3773/0160089 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3773/0160089?
Yes, KEHONG BIO provides custom synthesis services for A3773/0160089 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.