A3887/0165282
TL;DR: A3887/0165282 (CAS 728882-98-2) is a chemical compound with molecular formula C24H25N5O2 and molecular weight 415.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(dimethylamino)-7,7-dimethyl-2',5-dioxo-1'-prop-2-ynylspiro[6,8-dihydroquinoline-4,3'-indole]-3-carbonitrile
Also Known As: A3887/0165282, 2-amino-1-(dimethylamino)-7,7-dimethyl-2',5-dioxo-1'-prop-2-ynylspiro[6,8-dihydroquinoline-4,3'-indole]-3-carbonitrile, 2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-(prop-2-yn-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile, 2'-AMINO-1'-(DIMETHYLAMINO)-7',7'-DIMETHYL-2,5'-DIOXO-1-PROP-2-YN-1-YL-1,2,5',6',7',8'-HEXAHYDRO-1'H-SPIRO[INDOLE-3,4'-QUINOLINE]-3'-CARBONITRILE, 2-amino-1-(dimethylamino)-7,7-dimethyl-5,12-dioxo-11-prop-2-ynylspiro[1,4,6,7, 8-pentahydroquinoline-4,3'-indoline]-3-carbonitrile
| Molecular Formula | C24H25N5O2 |
|---|---|
| Molecular Weight | 415.20 g/mol |
| LogP | 2.03348 |
| Topological Polar Surface Area | 93.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 415.20084 |
| Heavy Atoms | 31 |
| Complexity | 1161.1451 |
Chemical Identifiers
| CAS Number | 728882-98-2 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC#C)C(=C(N2N(C)C)N)C#N)C |
Product Overview
A3887/0165282 (CAS 728882-98-2), with molecular formula C24H25N5O2 and molecular weight 415.20 g/mol. IUPAC: 2-amino-1-(dimethylamino)-7,7-dimethyl-2',5-dioxo-1'-prop-2-ynylspiro[6,8-dihydroquinoline-4,3'-indole]-3-carbonitrile.
Chemical Property Profile of A3887/0165282
Property Insights of A3887/0165282
The XLogP value of 2.03348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3887/0165282. The TPSA of 93.67 Ų falls within the moderate polarity range, balancing permeability and solubility for A3887/0165282. Following Lipinski's Rule of Five, A3887/0165282 has 1 hydrogen bond donor(s) and 6 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 A3887/0165282?
The CAS number of A3887/0165282 is 728882-98-2.
What is the molecular formula of A3887/0165282?
The molecular formula of A3887/0165282 is C24H25N5O2.
What is the molecular weight of A3887/0165282?
The molecular weight of A3887/0165282 is 415.20 g/mol.
Where can I buy A3887/0165282?
You can request a quote for A3887/0165282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3887/0165282?
Yes, KEHONG BIO provides custom synthesis services for A3887/0165282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.