AB00090412-01
TL;DR: AB00090412-01 (CAS 340982-71-0) is a chemical compound with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(3-nitrophenyl)methylideneamino]spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
Also Known As: AB00090412-01, 4-[(3-nitrobenzylidene)amino]-spiro[4-azatricyclo[5.2.1.0~2,6~]dec[8]ene-10,1'-cyclopropane]-3,5-dione, (E)-2-((3-nitrobenzylidene)amino)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, 2-{[(E)-(3-nitrophenyl)methylidene]amino}-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, 4-[(E)-(3-nitrophenyl)methylideneamino]spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
| Molecular Formula | C18H15N3O4 |
|---|---|
| Molecular Weight | 337.11 g/mol |
| LogP | 2.1259 |
| Topological Polar Surface Area | 92.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.10626 |
| Heavy Atoms | 25 |
| Complexity | 852.0623 |
Chemical Identifiers
| CAS Number | 340982-71-0 |
|---|---|
| SMILES | C1CC12C3C=CC2C4C3C(=O)N(C4=O)/N=C/C5=CC(=CC=C5)[N+](=O)[O-] |
Product Overview
AB00090412-01 (CAS 340982-71-0), with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol. IUPAC: 4-[(E)-(3-nitrophenyl)methylideneamino]spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione.
Chemical Property Profile of AB00090412-01
Property Insights of AB00090412-01
The XLogP value of 2.1259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00090412-01. The TPSA of 92.88 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00090412-01. Following Lipinski's Rule of Five, AB00090412-01 has 0 hydrogen bond donor(s) and 5 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 AB00090412-01?
The CAS number of AB00090412-01 is 340982-71-0.
What is the molecular formula of AB00090412-01?
The molecular formula of AB00090412-01 is C18H15N3O4.
What is the molecular weight of AB00090412-01?
The molecular weight of AB00090412-01 is 337.11 g/mol.
Where can I buy AB00090412-01?
You can request a quote for AB00090412-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00090412-01?
Yes, KEHONG BIO provides custom synthesis services for AB00090412-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.