9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole
TL;DR: 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole (CAS 27164-56-3) is a chemical compound with molecular formula C22H22N4O5 and molecular weight 422.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-N-[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]benzamide
Also Known As: 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole, 3,5-Dinitro-N-[3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propyl]benzamide, 3,5-dinitro-N-[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]benzamide, 3,5-dinitro-N-[3-(2,3,4,9-tetrahydro-1H-carbazol-9-yl)propyl]benzamide, Benzamide, 3,5-dinitro-N-[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-
| Molecular Formula | C22H22N4O5 |
|---|---|
| Molecular Weight | 422.16 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.15903 |
| Heavy Atoms | 31 |
| Complexity | 656.0 |
Chemical Identifiers
| CAS Number | 27164-56-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=CC=CC=C3N2CCCNC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | XUCYUJTZKJXOSL-UHFFFAOYSA-N |
Product Overview
9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole (CAS 27164-56-3), with molecular formula C22H22N4O5 and molecular weight 422.16 g/mol. IUPAC: 3,5-dinitro-N-[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]benzamide.
Chemical Property Profile of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole
Property Insights of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole
The XLogP value of 4.2 indicates that 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole. Following Lipinski's Rule of Five, 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole has 1 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 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole?
The CAS number of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole is 27164-56-3.
What is the molecular formula of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole?
The molecular formula of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole is C22H22N4O5.
What is the molecular weight of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole?
The molecular weight of 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole is 422.16 g/mol.
Where can I buy 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole?
You can request a quote for 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole?
Yes, KEHONG BIO provides custom synthesis services for 9-(3-(3,5-Dinitrobenzoylamino)propyl)-1,2,3,4-tetrahydrocarbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.