SU11248 analog 12a
TL;DR: SU11248 analog 12a (CAS 356068-91-2) is a chemical compound with molecular formula C22H28N4O2 and molecular weight 380.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxamide
Also Known As: SU11248 analog 12a, TH 11077, W-2616, N-[2-(Diethylamino)ethyl]-2,4-dimethyl-5-[(Z)-(2-oxoindolin-3-ylidene)methyl]-1H-pyrrole-3-carboxamide (Desfluorosunitinib), N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-{[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrole-3-carboxamide
| Molecular Formula | C22H28N4O2 |
|---|---|
| Molecular Weight | 380.22 g/mol |
| LogP | 3.19584 |
| Topological Polar Surface Area | 77.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.22122 |
| Heavy Atoms | 28 |
| Complexity | 922.6131 |
Chemical Identifiers
| CAS Number | 356068-91-2 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=C(NC(=C1C)/C=C\2/C3=CC=CC=C3NC2=O)C |
Product Overview
SU11248 analog 12a (CAS 356068-91-2), with molecular formula C22H28N4O2 and molecular weight 380.22 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrole-3-carboxamide.
Chemical Property Profile of SU11248 analog 12a
Property Insights of SU11248 analog 12a
The XLogP value of 3.19584 indicates that SU11248 analog 12a is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.23 Ų falls within the moderate polarity range, balancing permeability and solubility for SU11248 analog 12a. Following Lipinski's Rule of Five, SU11248 analog 12a has 3 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 SU11248 analog 12a?
The CAS number of SU11248 analog 12a is 356068-91-2.
What is the molecular formula of SU11248 analog 12a?
The molecular formula of SU11248 analog 12a is C22H28N4O2.
What is the molecular weight of SU11248 analog 12a?
The molecular weight of SU11248 analog 12a is 380.22 g/mol.
Where can I buy SU11248 analog 12a?
You can request a quote for SU11248 analog 12a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SU11248 analog 12a?
Yes, KEHONG BIO provides custom synthesis services for SU11248 analog 12a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.