![propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate structure](/static/products/1009/1009283-52-6.webp)
propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
TL;DR: propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate (CAS 1009283-52-6) is a chemical compound with molecular formula C18H23N3O5S and molecular weight 393.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
Also Known As: propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate, 2-[1-[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-3-oxo-2-piperazinyl]acetic acid propan-2-yl ester, 2-[3-keto-1-(p-anisoylthiocarbamoyl)piperazin-2-yl]acetic acid isopropyl ester, isopropyl (1-{[(4-methoxybenzoyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)acetate, propan-2-yl (1-{[(4-methoxyphenyl)carbonyl]carbamothioyl}-3-oxopiperazin-2-yl)acetate
| Molecular Formula | C18H23N3O5S |
|---|---|
| Molecular Weight | 393.14 g/mol |
| LogP | 0.852 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.13583 |
| Heavy Atoms | 27 |
| Complexity | 720.2122 |
Chemical Identifiers
| CAS Number | 1009283-52-6 |
|---|---|
| SMILES | CC(C)OC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C2=CC=C(C=C2)OC |
Product Overview
propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate (CAS 1009283-52-6), with molecular formula C18H23N3O5S and molecular weight 393.14 g/mol. IUPAC: propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
Property Insights of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
The XLogP value of 0.852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate. Following Lipinski's Rule of Five, propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate has 2 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 propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate?
The CAS number of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate is 1009283-52-6.
What is the molecular formula of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate?
The molecular formula of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate is C18H23N3O5S.
What is the molecular weight of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate?
The molecular weight of propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate is 393.14 g/mol.
Where can I buy propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate?
You can request a quote for propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 2-[1-[(4-methoxybenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.