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Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- structure
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Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-

TL;DR: Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- (CAS 130111-94-3) is a chemical compound with molecular formula C11H12ClN3O2S and molecular weight 285.03387 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[3-chloro-2-(4-methoxyphenyl)-4-oxoazetidin-1-yl]thiourea

Also Known As: (3-Chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)thiourea, Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-, [3-chloro-2-(4-methoxyphenyl)-4-oxoazetidin-1-yl]thiourea, N-[3-Chloro-2-(4-methoxyphenyl)-4-oxoazetidin-1-yl]carbamimidothioic acid, BRN 4259302

CAS Number
130111-94-3
Molecular Formula
C11H12ClN3O2S
Molecular Weight
285.03387 g/mol
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Technical Specifications

Molecular FormulaC11H12ClN3O2S
Molecular Weight285.03387 g/mol
XLogP1.2
Topological Polar Surface Area (TPSA)99.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass285.03387 Da
Heavy Atoms18
Complexity347.0
SMILESCOC1=CC=C(C=C1)C2C(C(=O)N2NC(=S)N)Cl
InChIKeyYMRZZAJAAXRRNB-UHFFFAOYSA-N

Chemical Property Profile of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-

XLogP
1.2
TPSA (Topological Polar Surface Area)
99.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
18
Complexity
347.0
Exact Mass
285.03387
Monoisotopic Mass
285.03387
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-

The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-. Following Lipinski's Rule of Five, Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-?

The CAS number of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- is 130111-94-3.

What is the molecular formula of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-?

The molecular formula of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- is C11H12ClN3O2S.

What is the molecular weight of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-?

The molecular weight of Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- is 285.03387 g/mol.

Where can I buy Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-?

You can request a quote for Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)-?

Yes, CoreyChem provides custom synthesis services for Thiourea, (3-chloro-2-(4-methoxyphenyl)-4-oxo-1-azetidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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