C29H21ClN6O3
TL;DR: C29H21ClN6O3 (CAS 383371-06-0) is a chemical compound with molecular formula C29H21ClN6O3 and molecular weight 536.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2E)-2-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-N-phenylbenzamide
Also Known As: (E)-4-(2-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)hydrazinyl)-3-nitro-N-phenylbenzamide, 4-[(2E)-2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}hydrazinyl]-3-nitro-N-phenylbenzamide, 4-[2-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-N-phenyl-benzamide
| Molecular Formula | C29H21ClN6O3 |
|---|---|
| Molecular Weight | 536.14 g/mol |
| LogP | 6.7992 |
| Topological Polar Surface Area | 114.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 536.13635 |
| Heavy Atoms | 39 |
| Complexity | 1652.285 |
Chemical Identifiers
| CAS Number | 383371-06-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N/N=C/C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5)[N+](=O)[O-] |
Product Overview
C29H21ClN6O3 (CAS 383371-06-0), with molecular formula C29H21ClN6O3 and molecular weight 536.14 g/mol. IUPAC: 4-[(2E)-2-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]hydrazinyl]-3-nitro-N-phenylbenzamide.
Chemical Property Profile of C29H21ClN6O3
Property Insights of C29H21ClN6O3
The XLogP value of 6.7992 indicates that C29H21ClN6O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.45 Ų falls within the moderate polarity range, balancing permeability and solubility for C29H21ClN6O3. Following Lipinski's Rule of Five, C29H21ClN6O3 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C29H21ClN6O3?
The CAS number of C29H21ClN6O3 is 383371-06-0.
What is the molecular formula of C29H21ClN6O3?
The molecular formula of C29H21ClN6O3 is C29H21ClN6O3.
What is the molecular weight of C29H21ClN6O3?
The molecular weight of C29H21ClN6O3 is 536.14 g/mol.
Where can I buy C29H21ClN6O3?
You can request a quote for C29H21ClN6O3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C29H21ClN6O3?
Yes, KEHONG BIO provides custom synthesis services for C29H21ClN6O3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.