AB00093182-01
TL;DR: AB00093182-01 (CAS 300804-77-7) is a chemical compound with molecular formula C20H22N2O6 and molecular weight 386.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O'-tert-butyl 3-O'-methyl 2'-amino-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
Also Known As: AB00093182-01, 5'-tert-butyl 3'-methyl 2'-amino-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate, 5'-tert-butyl 3'-methyl 2'-amino-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate, 5-O'-tert-butyl 3-O'-methyl 2'-amino-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
| Molecular Formula | C20H22N2O6 |
|---|---|
| Molecular Weight | 386.15 g/mol |
| LogP | 1.8657 |
| Topological Polar Surface Area | 116.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.1478 |
| Heavy Atoms | 28 |
| Complexity | 953.68774 |
Chemical Identifiers
| CAS Number | 300804-77-7 |
|---|---|
| SMILES | CC1=C(C2(C3=CC=CC=C3NC2=O)C(=C(O1)N)C(=O)OC)C(=O)OC(C)(C)C |
Product Overview
AB00093182-01 (CAS 300804-77-7), with molecular formula C20H22N2O6 and molecular weight 386.15 g/mol. IUPAC: 5-O'-tert-butyl 3-O'-methyl 2'-amino-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate.
Chemical Property Profile of AB00093182-01
Property Insights of AB00093182-01
The XLogP value of 1.8657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00093182-01. The TPSA of 116.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00093182-01. Following Lipinski's Rule of Five, AB00093182-01 has 2 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 AB00093182-01?
The CAS number of AB00093182-01 is 300804-77-7.
What is the molecular formula of AB00093182-01?
The molecular formula of AB00093182-01 is C20H22N2O6.
What is the molecular weight of AB00093182-01?
The molecular weight of AB00093182-01 is 386.15 g/mol.
Where can I buy AB00093182-01?
You can request a quote for AB00093182-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00093182-01?
Yes, KEHONG BIO provides custom synthesis services for AB00093182-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.