![3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide structure](/static/products/488/488723-20-2.png)
3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide
TL;DR: 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide (CAS 488723-20-2) is a chemical compound with molecular formula C21H18BrN5O3 and molecular weight 467.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[2-[[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]diazenyl]-2-oxoethyl]benzamide
Also Known As: 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide, 3-bromo-N-[2-[2-[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]hydrazinyl]-2-oxoethyl]benzamide, (Z)-3-bromo-N-(2-(2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinyl)-2-oxoethyl)benzamide, 3-bromo-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)benzamide (non-preferred name), 3-bromo-N-[2-[(2E)-2-[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]hydrazinyl]-2-oxoethyl]benzamide
| Molecular Formula | C21H18BrN5O3 |
|---|---|
| Molecular Weight | 467.06 g/mol |
| LogP | 4.45348 |
| Topological Polar Surface Area | 119.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 467.0593 |
| Heavy Atoms | 30 |
| Complexity | 1163.1484 |
Chemical Identifiers
| CAS Number | 488723-20-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2CCCC#N)O)N=NC(=O)CNC(=O)C3=CC(=CC=C3)Br |
Product Overview
3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide (CAS 488723-20-2), with molecular formula C21H18BrN5O3 and molecular weight 467.06 g/mol. IUPAC: 3-bromo-N-[2-[[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]diazenyl]-2-oxoethyl]benzamide.
Chemical Property Profile of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide
Property Insights of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide
The XLogP value of 4.45348 indicates that 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide. Following Lipinski's Rule of Five, 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide 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-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide?
The CAS number of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide is 488723-20-2.
What is the molecular formula of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide?
The molecular formula of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide is C21H18BrN5O3.
What is the molecular weight of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide?
The molecular weight of 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide is 467.06 g/mol.
Where can I buy 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide?
You can request a quote for 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-[[[1-(3-cyanopropyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.