NCI60_007375
TL;DR: NCI60_007375 (CAS 345895-75-2) is a chemical compound with molecular formula C36H28N6O6 and molecular weight 640.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[4-[2-acetamido-2-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]phenyl]-1-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]acetamide
Also Known As: NCI60_007375, Acetamide, N,N'-[1,4-phenylenebis[1-(3a,4,9,9a-tetrahydro-4,9-dioxo-1H-naphth[2,3-d]imidazol-2-yl)-2,1-ethenediyl]]bis-, Acetamide, N,Na(2)-[1,4-phenylenebis[1-(3a,4,9,9a-tetrahydro-4,9-dioxo-1H-naphth[2,3-d]imidazol-2-yl)-2,1-ethenediyl]]bis-, N-[2-[4-[2-acetamido-2-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]phenyl]-1-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]acetamide
| Molecular Formula | C36H28N6O6 |
|---|---|
| Molecular Weight | 640.21 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 640.20703 |
| Heavy Atoms | 48 |
| Complexity | 1440.0 |
Chemical Identifiers
| CAS Number | 345895-75-2 |
|---|---|
| SMILES | CC(=O)NC(=CC1=CC=C(C=C1)C=C(C2=NC3C(N2)C(=O)C4=CC=CC=C4C3=O)NC(=O)C)C5=NC6C(N5)C(=O)C7=CC=CC=C7C6=O |
| InChIKey | JCIXNTQVQXGQAS-UHFFFAOYSA-N |
Product Overview
NCI60_007375 (CAS 345895-75-2), with molecular formula C36H28N6O6 and molecular weight 640.21 g/mol. IUPAC: N-[2-[4-[2-acetamido-2-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]phenyl]-1-(4,9-dioxo-3a,9a-dihydro-1H-benzo[f]benzimidazol-2-yl)ethenyl]acetamide.
Chemical Property Profile of NCI60_007375
Property Insights of NCI60_007375
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCI60_007375. The TPSA of 175.0 Ų indicates high polarity, suggesting NCI60_007375 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NCI60_007375 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_007375?
The CAS number of NCI60_007375 is 345895-75-2.
What is the molecular formula of NCI60_007375?
The molecular formula of NCI60_007375 is C36H28N6O6.
What is the molecular weight of NCI60_007375?
The molecular weight of NCI60_007375 is 640.21 g/mol.
Where can I buy NCI60_007375?
You can request a quote for NCI60_007375 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_007375?
Yes, KEHONG BIO provides custom synthesis services for NCI60_007375 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.