![N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide structure](/static/products/488/488734-63-0.png)
N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide
TL;DR: N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide (CAS 488734-63-0) is a chemical compound with molecular formula C20H16IN5O3 and molecular weight 501.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[1-(2-cyanoethyl)-2-hydroxyindol-3-yl]diazenyl]-2-oxoethyl]-2-iodobenzamide
Also Known As: N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide, N-[2-[2-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]hydrazinyl]-2-oxoethyl]-2-iodobenzamide, (Z)-N-(2-(2-(1-(2-cyanoethyl)-2-oxoindolin-3-ylidene)hydrazinyl)-2-oxoethyl)-2-iodobenzamide, N-(2-{(2Z)-2-[1-(2-cyanoethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2-iodobenzamide (non-preferred name), N-[2-[(2E)-2-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]hydrazinyl]-2-oxoethyl]-2-iodobenzamide
| Molecular Formula | C20H16IN5O3 |
|---|---|
| Molecular Weight | 501.03 g/mol |
| LogP | 3.90548 |
| Topological Polar Surface Area | 119.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 501.0298 |
| Heavy Atoms | 29 |
| Complexity | 1146.7145 |
Chemical Identifiers
| CAS Number | 488734-63-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2CCC#N)O)N=NC(=O)CNC(=O)C3=CC=CC=C3I |
Product Overview
N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide (CAS 488734-63-0), with molecular formula C20H16IN5O3 and molecular weight 501.03 g/mol. IUPAC: N-[2-[[1-(2-cyanoethyl)-2-hydroxyindol-3-yl]diazenyl]-2-oxoethyl]-2-iodobenzamide.
Chemical Property Profile of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide
Property Insights of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide
The XLogP value of 3.90548 indicates that N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-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 N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide. Following Lipinski's Rule of Five, N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide?
The CAS number of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide is 488734-63-0.
What is the molecular formula of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide?
The molecular formula of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide is C20H16IN5O3.
What is the molecular weight of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide?
The molecular weight of N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide is 501.03 g/mol.
Where can I buy N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide?
You can request a quote for N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[[1-(2-cyanoethyl)-2-oxo-indol-3-ylidene]amino]carbamoylmethyl]-2-iodo-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.