![(Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate structure](/static/products/849/849006-88-8.png)
(Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate
TL;DR: (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate (CAS 849006-88-8) is a chemical compound with molecular formula C19H25N3O3S and molecular weight 375.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-anilino-7,7-dimethyl-2-sulfanylidene-8-oxa-1,3-diazaspiro[4.5]dec-3-en-1-yl)acetate
Also Known As: (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate, ethyl [(4Z)-7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]dec-1-yl]acetate, ethyl 2-(1-anilino-9,9-dimethyl-3-sulfanylidene-8-oxa-2,4-diazaspiro[4.5]dec-1-en-4-yl)acetate
| Molecular Formula | C19H25N3O3S |
|---|---|
| Molecular Weight | 375.16 g/mol |
| LogP | 2.9884 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.16165 |
| Heavy Atoms | 26 |
| Complexity | 719.9993 |
Chemical Identifiers
| CAS Number | 849006-88-8 |
|---|---|
| SMILES | CCOC(=O)CN1C(=S)N=C(C12CCOC(C2)(C)C)NC3=CC=CC=C3 |
Product Overview
(Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate (CAS 849006-88-8), with molecular formula C19H25N3O3S and molecular weight 375.16 g/mol. IUPAC: ethyl 2-(4-anilino-7,7-dimethyl-2-sulfanylidene-8-oxa-1,3-diazaspiro[4.5]dec-3-en-1-yl)acetate.
Chemical Property Profile of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate
Property Insights of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate
The XLogP value of 2.9884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate. Following Lipinski's Rule of Five, (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate 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 (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate?
The CAS number of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate is 849006-88-8.
What is the molecular formula of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate?
The molecular formula of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate is C19H25N3O3S.
What is the molecular weight of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate?
The molecular weight of (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate is 375.16 g/mol.
Where can I buy (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate?
You can request a quote for (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 2-(7,7-dimethyl-4-(phenylimino)-2-thioxo-8-oxa-1,3-diazaspiro[4.5]decan-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.