![7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one structure](/static/products/879/879435-68-4.png)
7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one
TL;DR: 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one (CAS 879435-68-4) is a chemical compound with molecular formula C23H12N4O3S and molecular weight 424.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(3-nitrophenyl)-14-thia-3,10,12-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-21-one
Also Known As: 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one, 7-(3-nitrophenyl)-14H-thiochromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
| Molecular Formula | C23H12N4O3S |
|---|---|
| Molecular Weight | 424.06 g/mol |
| LogP | 5.1858 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 424.06302 |
| Heavy Atoms | 31 |
| Complexity | 1753.4344 |
Chemical Identifiers
| CAS Number | 879435-68-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(S2)N=C(N4C3=NC5=CC=CC=C54)C6=CC(=CC=C6)[N+](=O)[O-] |
Product Overview
7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one (CAS 879435-68-4), with molecular formula C23H12N4O3S and molecular weight 424.06 g/mol. IUPAC: 11-(3-nitrophenyl)-14-thia-3,10,12-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-21-one.
Chemical Property Profile of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one
Property Insights of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one
The XLogP value of 5.1858 indicates that 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one. Following Lipinski's Rule of Five, 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one has 0 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 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one?
The CAS number of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one is 879435-68-4.
What is the molecular formula of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one?
The molecular formula of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one is C23H12N4O3S.
What is the molecular weight of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one?
The molecular weight of 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one is 424.06 g/mol.
Where can I buy 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one?
You can request a quote for 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(3-nitrophenyl)-14H-benzo[4,5]imidazo[1,2-c]thiochromeno[3,2-e]pyrimidin-14-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.