AB00674001-01
TL;DR: AB00674001-01 (CAS 329923-01-5) is a chemical compound with molecular formula C22H19N3O5 and molecular weight 405.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-7,7-dimethyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: AB00674001-01, F1336-0013, 2-amino-7,7-dimethyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 2-amino-7,7-dimethyl-4-(5-(3-nitrophenyl)furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 2-amino-7,7-dimethyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
| Molecular Formula | C22H19N3O5 |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 4.30568 |
| Topological Polar Surface Area | 132.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.13248 |
| Heavy Atoms | 30 |
| Complexity | 1179.3751 |
Chemical Identifiers
| CAS Number | 329923-01-5 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C1)C |
Product Overview
AB00674001-01 (CAS 329923-01-5), with molecular formula C22H19N3O5 and molecular weight 405.13 g/mol. IUPAC: 2-amino-7,7-dimethyl-4-[5-(3-nitrophenyl)furan-2-yl]-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of AB00674001-01
Property Insights of AB00674001-01
The XLogP value of 4.30568 indicates that AB00674001-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674001-01. Following Lipinski's Rule of Five, AB00674001-01 has 1 hydrogen bond donor(s) and 7 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 AB00674001-01?
The CAS number of AB00674001-01 is 329923-01-5.
What is the molecular formula of AB00674001-01?
The molecular formula of AB00674001-01 is C22H19N3O5.
What is the molecular weight of AB00674001-01?
The molecular weight of AB00674001-01 is 405.13 g/mol.
Where can I buy AB00674001-01?
You can request a quote for AB00674001-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674001-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674001-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.