1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea

C10H9ClN4OS — CID 145980671

IUPAC1-(2-chloro-4-pyridinyl)-3-(4-methyl-1,3-thiazol-2-yl)urea
SMILESCC1=CSC(=N1)NC(=O)NC2=CC(=NC=C2)Cl
InChIInChI=1S/C10H9ClN4OS/c1-6-5-17-10(13-6)15-9(16)14-7-2-3-12-8(11)4-7/h2-5H,1H3,(H2,12,13,14,15,16)
InChIKeyAPFPJIWYBJHIHN-UHFFFAOYSA-N
MW268.72 g/mol
LogP2.10
Rot. Bonds2

About 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea

1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea (PubChem CID 145980671) has the molecular formula C10H9ClN4OS and a molecular weight of 268.72 g/mol. Its IUPAC name is 1-(2-chloro-4-pyridinyl)-3-(4-methyl-1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea
PubChem CID145980671
Molecular FormulaC10H9ClN4OS
Molecular Weight268.72 g/mol
Exact Mass268.02
IUPAC Name1-(2-chloro-4-pyridinyl)-3-(4-methyl-1,3-thiazol-2-yl)urea
SMILESCC1=CSC(=N1)NC(=O)NC2=CC(=NC=C2)Cl
InChIInChI=1S/C10H9ClN4OS/c1-6-5-17-10(13-6)15-9(16)14-7-2-3-12-8(11)4-7/h2-5H,1H3,(H2,12,13,14,15,16)
InChIKeyAPFPJIWYBJHIHN-UHFFFAOYSA-N
XLogP2.10
TPSA95.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity281

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.72
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-chloropyridin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 973099
Urea, N-(3-chlorophenyl)-N'-2-thiazolyl-
CID 178054
N-(3-chlorophenyl)-4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-amine
CID 6539282
N-(4-chlorophenyl)-4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-amine
CID 6539283
(4-Chloro-phenyl)-(4-pyridin-4-yl-thiazol-2-yl)-amine
CID 704499
1-Phenyl-3-(4-pyridin-2-yl-thiazol-2-yl)-urea
CID 10590030
N-(3-{2-[(5-chloro-2-pyridinyl)amino]-1,3-thiazol-4-yl}phenyl)acetamide
CID 2215490
1-(2,4-Difluorophenyl)-3-[4-(2-pyridinyl)-2-thiazolyl]urea
CID 4799115
N-(4-chlorophenyl)-4-(3-pyridinyl)-1,3-thiazol-2-amine
CID 704584
N-(3-Chlorophenyl)-4-(4-pyridinyl)-1,3-thiazol-2-amine
CID 1092467
1-[(3-Chlorophenyl)methyl]-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)urea
CID 87405158
1-[(2-Chlorophenyl)methyl]-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)urea
CID 87405928

Frequently Asked Questions

What is the IUPAC name of 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea?
The IUPAC name of 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea (CID 145980671) is 1-(2-chloro-4-pyridinyl)-3-(4-methyl-1,3-thiazol-2-yl)urea.
What is the SMILES notation for 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea?
The canonical SMILES for 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea is CC1=CSC(=N1)NC(=O)NC2=CC(=NC=C2)Cl.
What is the InChIKey of 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea?
The InChIKey is APFPJIWYBJHIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4OS/c1-6-5-17-10(13-6)15-9(16)14-7-2-3-12-8(11)4-7/h2-5H,1H3,(H2,12,13,14,15,16).
What are the key properties of 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea?
1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea has a molecular weight of 268.72 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-Chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)urea is sourced from PubChem (CID 145980671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).