1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione
TL;DR: 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione (CAS 499-51-4) is a chemical compound with molecular formula C13H8N4O2 and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dihydro-1H-benzimidazolo[5,6-b][1,8]naphthyridine-2,10-dione
Also Known As: NCI60_021451, 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione, 3,5-dihydro-1H-benzimidazolo[5,6-b][1,8]naphthyridine-2,10-dione, 1H-[1,3]Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione
| Molecular Formula | C13H8N4O2 |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.06473 |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 499-51-4 |
|---|---|
| SMILES | C1=CC2=C(NC3=CC4=C(C=C3C2=O)NC(=O)N4)N=C1 |
| InChIKey | SGGXTMSSHMVAEE-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione (CAS 499-51-4), with molecular formula C13H8N4O2 and molecular weight 252.06 g/mol. IUPAC: 3,5-dihydro-1H-benzimidazolo[5,6-b][1,8]naphthyridine-2,10-dione.
Chemical Property Profile of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione
Property Insights of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione. Following Lipinski's Rule of Five, 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione has 3 hydrogen bond donor(s) and 4 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 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione?
The CAS number of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione is 499-51-4.
What is the molecular formula of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione?
The molecular formula of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione is C13H8N4O2.
What is the molecular weight of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione?
The molecular weight of 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione is 252.06 g/mol.
Where can I buy 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione?
You can request a quote for 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazo[5,6-b][1,8]naphthyridine-2,10(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.