2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one
TL;DR: 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one (CAS 731003-87-5) is a chemical compound with molecular formula C12H12ClNO and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one
Also Known As: 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one, 2-Chloro-1-(2-methyl-1H-indol-3-yl)-propan-1-one, BAS 11572127, BB 0258004, 2-chloro-1-(2-methylindol-3-yl)propan-1-one
| Molecular Formula | C12H12ClNO |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 3.28632 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.06075 |
| Heavy Atoms | 15 |
| Complexity | 513.3165 |
Chemical Identifiers
| CAS Number | 731003-87-5 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C(=O)C(C)Cl |
Product Overview
2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one (CAS 731003-87-5), with molecular formula C12H12ClNO and molecular weight 221.06 g/mol. IUPAC: 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one.
Chemical Property Profile of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one
Property Insights of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one
The XLogP value of 3.28632 indicates that 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one has 1 hydrogen bond donor(s) and 1 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 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one?
The CAS number of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one is 731003-87-5.
What is the molecular formula of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one?
The molecular formula of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one is C12H12ClNO.
What is the molecular weight of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one?
The molecular weight of 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one is 221.06 g/mol.
Where can I buy 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one?
You can request a quote for 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-1-(2-methyl-1H-indol-3-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.