BAS 09588715
TL;DR: BAS 09588715 (CAS 27463-39-4) is a chemical compound with molecular formula C17H16ClNO3 and molecular weight 317.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate
Also Known As: BAS 09588715, methyl 6-(4-chlorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate, A3242/0137702, Methyl 6-(4-chlorophenyl)-4,5,6,7-tetrahydro-3-methyl-4-oxo-1H-indole-2-carboxylate, methyl 6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate
| Molecular Formula | C17H16ClNO3 |
|---|---|
| Molecular Weight | 317.08 g/mol |
| LogP | 3.67582 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.08188 |
| Heavy Atoms | 22 |
| Complexity | 746.0097 |
Chemical Identifiers
| CAS Number | 27463-39-4 |
|---|---|
| SMILES | CC1=C(NC2=C1C(=O)CC(C2)C3=CC=C(C=C3)Cl)C(=O)OC |
Product Overview
BAS 09588715 (CAS 27463-39-4), with molecular formula C17H16ClNO3 and molecular weight 317.08 g/mol. IUPAC: methyl 6-(4-chlorophenyl)-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate.
Chemical Property Profile of BAS 09588715
Property Insights of BAS 09588715
The XLogP value of 3.67582 indicates that BAS 09588715 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.16 Ų, BAS 09588715 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 09588715 has 1 hydrogen bond donor(s) and 3 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 BAS 09588715?
The CAS number of BAS 09588715 is 27463-39-4.
What is the molecular formula of BAS 09588715?
The molecular formula of BAS 09588715 is C17H16ClNO3.
What is the molecular weight of BAS 09588715?
The molecular weight of BAS 09588715 is 317.08 g/mol.
Where can I buy BAS 09588715?
You can request a quote for BAS 09588715 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09588715?
Yes, KEHONG BIO provides custom synthesis services for BAS 09588715 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.