4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione
TL;DR: 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione (CAS 227459-19-0) is a chemical compound with molecular formula C14H9ClN2O2S and molecular weight 304.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)sulfanyl-6-methylpyrrolo[3,4-c]pyridine-1,3-dione
Also Known As: Maybridge4_003072, BRD-K75421065-001-01-3, BRD-K75421065-001-02-1, 4-(4-chlorophenyl)sulfanyl-6-methylpyrrolo[3,4-c]pyridine-1,3-dione, 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione
| Molecular Formula | C14H9ClN2O2S |
|---|---|
| Molecular Weight | 304.01 g/mol |
| LogP | 3.07822 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.00732 |
| Heavy Atoms | 20 |
| Complexity | 728.6989 |
Chemical Identifiers
| CAS Number | 227459-19-0 |
|---|---|
| SMILES | CC1=CC2=C(C(=O)NC2=O)C(=N1)SC3=CC=C(C=C3)Cl |
Product Overview
4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione (CAS 227459-19-0), with molecular formula C14H9ClN2O2S and molecular weight 304.01 g/mol. IUPAC: 4-(4-chlorophenyl)sulfanyl-6-methylpyrrolo[3,4-c]pyridine-1,3-dione.
Chemical Property Profile of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione
Property Insights of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione
The XLogP value of 3.07822 indicates that 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione has 1 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 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione?
The CAS number of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione is 227459-19-0.
What is the molecular formula of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione?
The molecular formula of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione is C14H9ClN2O2S.
What is the molecular weight of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione?
The molecular weight of 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione is 304.01 g/mol.
Where can I buy 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione?
You can request a quote for 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Chlorophenyl)thio]-6-methyl-1h-pyrrolo[3,4-c]pyridine-1,3(2h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.