![3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile structure](/static/products/1018/101831-72-5.webp)
3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile
TL;DR: 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile (CAS 101831-72-5) is a chemical compound with molecular formula C11H8N6O and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile
Also Known As: (3E)-3-[2-azido-1-(hydroxyamino)ethylidene]indole-5-carbonitrile
| Molecular Formula | C11H8N6O |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 86.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.07596 |
| Heavy Atoms | 18 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 101831-72-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1C#N)C(=CN2)C(=NO)CN=[N+]=[N-] |
| InChIKey | JBIIRRVXJCSZPD-UHFFFAOYSA-N |
Product Overview
3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile (CAS 101831-72-5), with molecular formula C11H8N6O and molecular weight 240.08 g/mol. IUPAC: 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile.
Chemical Property Profile of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile
Property Insights of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile. Following Lipinski's Rule of Five, 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile has 2 hydrogen bond donor(s) and 5 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-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile?
The CAS number of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile is 101831-72-5.
What is the molecular formula of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile?
The molecular formula of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile is C11H8N6O.
What is the molecular weight of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile?
The molecular weight of 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile is 240.08 g/mol.
Where can I buy 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile?
You can request a quote for 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[C-(azidomethyl)-N-hydroxycarbonimidoyl]-1H-indole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.