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Spiro[5.5]undecane-3-carboxamide,4-dioxo-
TL;DR: Spiro[5.5]undecane-3-carboxamide,4-dioxo- (CAS 57641-80-2) is a chemical compound with molecular formula C19H23NO5S and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)sulfonyl-2,4-dioxospiro[5.5]undecane-3-carboxamide
Also Known As: Spiro[5.5]undecane-3-carboxamide,4-dioxo-, NCI60_002656, Spiro[5, N-[(4-methylphenyl)sulfonyl]-2,4-dioxo-, N-(4-methylphenyl)sulfonyl-2,4-dioxospiro[5.5]undecane-3-car, 3-[N-(p-TOLUENESULFONYL)CARBAMOYL]SPIRO-[5.5]UNDECANE-2,4-DIONE
| Molecular Formula | C19H23NO5S |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.1297 |
| Heavy Atoms | 26 |
| Complexity | 659.0 |
Chemical Identifiers
| CAS Number | 57641-80-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2C(=O)CC3(CCCCC3)CC2=O |
| InChIKey | IAIUMVPEFJQUIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Spiro[5.5]undecane-3-carboxamide,4-dioxo- (CAS 57641-80-2), with molecular formula C19H23NO5S and molecular weight 377.13 g/mol. IUPAC: N-(4-methylphenyl)sulfonyl-2,4-dioxospiro[5.5]undecane-3-carboxamide.
Chemical Property Profile of Spiro[5.5]undecane-3-carboxamide,4-dioxo-
Property Insights of Spiro[5.5]undecane-3-carboxamide,4-dioxo-
The XLogP value of 3.8 indicates that Spiro[5.5]undecane-3-carboxamide,4-dioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Spiro[5.5]undecane-3-carboxamide,4-dioxo-. Following Lipinski's Rule of Five, Spiro[5.5]undecane-3-carboxamide,4-dioxo- has 1 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 Spiro[5.5]undecane-3-carboxamide,4-dioxo-?
The CAS number of Spiro[5.5]undecane-3-carboxamide,4-dioxo- is 57641-80-2.
What is the molecular formula of Spiro[5.5]undecane-3-carboxamide,4-dioxo-?
The molecular formula of Spiro[5.5]undecane-3-carboxamide,4-dioxo- is C19H23NO5S.
What is the molecular weight of Spiro[5.5]undecane-3-carboxamide,4-dioxo-?
The molecular weight of Spiro[5.5]undecane-3-carboxamide,4-dioxo- is 377.13 g/mol.
Where can I buy Spiro[5.5]undecane-3-carboxamide,4-dioxo-?
You can request a quote for Spiro[5.5]undecane-3-carboxamide,4-dioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro[5.5]undecane-3-carboxamide,4-dioxo-?
Yes, KEHONG BIO provides custom synthesis services for Spiro[5.5]undecane-3-carboxamide,4-dioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.