![N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea structure](/static/products/4000/400086-27-3.webp)
N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea
TL;DR: N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea (CAS 400086-27-3) is a chemical compound with molecular formula C16H15Cl2N3OS and molecular weight 367.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-prop-2-enylthiourea
Also Known As: 7E-547, N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea, 1-[1-[(3,4-dichlorophenyl)methyl]-2-oxopyridin-3-yl]-3-prop-2-enylthiourea, 1-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-pyridin-3-yl]-3-prop-2-enyl-thiourea, 1-{1-[(3,4-dichlorophenyl)methyl]-2-oxo-1,2-dihydropyridin-3-yl}-3-(prop-2-en-1-yl)thiourea
| Molecular Formula | C16H15Cl2N3OS |
|---|---|
| Molecular Weight | 367.03 g/mol |
| LogP | 3.6758 |
| Topological Polar Surface Area | 46.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.03128 |
| Heavy Atoms | 23 |
| Complexity | 789.1351 |
Chemical Identifiers
| CAS Number | 400086-27-3 |
|---|---|
| SMILES | C=CCNC(=S)NC1=CC=CN(C1=O)CC2=CC(=C(C=C2)Cl)Cl |
Product Overview
N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea (CAS 400086-27-3), with molecular formula C16H15Cl2N3OS and molecular weight 367.03 g/mol. IUPAC: 1-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-prop-2-enylthiourea.
Chemical Property Profile of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea
Property Insights of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea
The XLogP value of 3.6758 indicates that N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.06 Ų, N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea has 2 hydrogen bond donor(s) and 2 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 N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea?
The CAS number of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea is 400086-27-3.
What is the molecular formula of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea?
The molecular formula of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea is C16H15Cl2N3OS.
What is the molecular weight of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea?
The molecular weight of N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea is 367.03 g/mol.
Where can I buy N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea?
You can request a quote for N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-N'-[1-(3,4-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.