(3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one
TL;DR: (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one (CAS 381716-98-9) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclopropyliminomethyl)-1H-indol-2-ol
Also Known As: 3-[(cyclopropylamino)methylidene]-1H-indol-2-one, (3E)-3-[(cyclopropylamino)methylidene]-1H-indol-2-one, (3Z)-3-[(cyclopropylamino)methylidene]-1H-indol-2-one, 3-[(cyclopropylamino)methylene]-1,3-dihydro-2H-indol-2-one, (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one
| Molecular Formula | C12H12N2O |
|---|---|
| Molecular Weight | 200.09 g/mol |
| LogP | 2.4548 |
| Topological Polar Surface Area | 48.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.09496 |
| Heavy Atoms | 15 |
| Complexity | 523.4017 |
Chemical Identifiers
| CAS Number | 381716-98-9 |
|---|---|
| SMILES | C1CC1N=CC2=C(NC3=CC=CC=C32)O |
Product Overview
(3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one (CAS 381716-98-9), with molecular formula C12H12N2O and molecular weight 200.09 g/mol. IUPAC: 3-(cyclopropyliminomethyl)-1H-indol-2-ol.
Chemical Property Profile of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one
Property Insights of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one
The XLogP value of 2.4548 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one. With a topological polar surface area (TPSA) of 48.38 Ų, (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one has 2 hydrogen bond donor(s) and 2 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 (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one?
The CAS number of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one is 381716-98-9.
What is the molecular formula of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one?
The molecular formula of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one is C12H12N2O.
What is the molecular weight of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one?
The molecular weight of (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one is 200.09 g/mol.
Where can I buy (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one?
You can request a quote for (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-3-[(cyclopropylamino)methylidene]-1,3-dihydro-2H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.