2-吲哚啉酮-3-亚基丙二腈
TL;DR: 2-吲哚啉酮-3-亚基丙二腈 (CAS 74141-51-8) is a chemical compound with molecular formula C11H5N3O and molecular weight 195.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-吲哚啉酮-3-亚基丙二腈
2-(2-oxo-1H-indol-3-ylidene)propanedinitrile
Also Known As: 2-(2-oxoindolin-3-ylidene)malononitrile, Bgg-spermidine, Tyrphostin deriv. 22, (2-oxo-1,2-dihydro-3h-indol-3-ylidene)malononitrile, 2-(2-oxo-1H-indol-3-ylidene)propanedinitrile
| Molecular Formula | C11H5N3O |
|---|---|
| Molecular Weight | 195.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.04326 |
| Heavy Atoms | 15 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 74141-51-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(C#N)C#N)C(=O)N2 |
| InChIKey | IXRCJYBQPZJHRZ-UHFFFAOYSA-N |
Product Overview
2-吲哚啉酮-3-亚基丙二腈 (CAS 74141-51-8), with molecular formula C11H5N3O and molecular weight 195.04 g/mol. IUPAC: 2-(2-oxo-1H-indol-3-ylidene)propanedinitrile.
Chemical Property Profile of 2-吲哚啉酮-3-亚基丙二腈
Property Insights of 2-吲哚啉酮-3-亚基丙二腈
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-吲哚啉酮-3-亚基丙二腈. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-吲哚啉酮-3-亚基丙二腈. Following Lipinski's Rule of Five, 2-吲哚啉酮-3-亚基丙二腈 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 2-吲哚啉酮-3-亚基丙二腈?
The CAS number of 2-吲哚啉酮-3-亚基丙二腈 is 74141-51-8.
What is the molecular formula of 2-吲哚啉酮-3-亚基丙二腈?
The molecular formula of 2-吲哚啉酮-3-亚基丙二腈 is C11H5N3O.
What is the molecular weight of 2-吲哚啉酮-3-亚基丙二腈?
The molecular weight of 2-吲哚啉酮-3-亚基丙二腈 is 195.04 g/mol.
Where can I buy 2-吲哚啉酮-3-亚基丙二腈?
You can request a quote for 2-吲哚啉酮-3-亚基丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-吲哚啉酮-3-亚基丙二腈?
Yes, KEHONG BIO provides custom synthesis services for 2-吲哚啉酮-3-亚基丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.