3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮
TL;DR: 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 (CAS 91822-51-4) is a chemical compound with molecular formula C13H10N2O and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮
3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one
Also Known As: 3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one, 3-((pyrrol-2-yl)methylene)-2-indolinone, 2H-Indol-2-one, 1,3-dihydro-3-(1H-pyrrol-2-ylmethylene)-, 3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydroindol-2-one, 1,3-Dihydro-3-(1H-pyrrol-2-ylmethylene)-2H-indol-2-one
| Molecular Formula | C13H10N2O |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 44.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.07932 |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 91822-51-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC3=CC=CN3)C(=O)N2 |
| InChIKey | SEZFNTZQMWJIAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 (CAS 91822-51-4), with molecular formula C13H10N2O and molecular weight 210.08 g/mol. IUPAC: 3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one.
Chemical Property Profile of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮
Property Insights of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮. With a topological polar surface area (TPSA) of 44.9 Ų, 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 has 2 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 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮?
The CAS number of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 is 91822-51-4.
What is the molecular formula of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮?
The molecular formula of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 is C13H10N2O.
What is the molecular weight of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮?
The molecular weight of 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 is 210.08 g/mol.
Where can I buy 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮?
You can request a quote for 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-吡咯-2-基亚甲基)-1H-吲哚-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.