1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea

C13H10N4OS — CID 47149919

IUPAC1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea
SMILESO=C(Nc1cnc2ccccc2c1)Nc1nccs1
InChIInChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)16-10-7-9-3-1-2-4-11(9)15-8-10/h1-8H,(H2,14,16,17,18)
InChIKeyYLGYYBKFPGZWSF-UHFFFAOYSA-N
MW270.32 g/mol
LogP3.34
Rot. Bonds2

About 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea

1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea (PubChem CID 47149919) has the molecular formula C13H10N4OS and a molecular weight of 270.32 g/mol. Its IUPAC name is 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea
PubChem CID47149919
Molecular FormulaC13H10N4OS
Molecular Weight270.32 g/mol
Exact Mass270.06
IUPAC Name1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea
SMILESO=C(Nc1cnc2ccccc2c1)Nc1nccs1
InChIInChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)16-10-7-9-3-1-2-4-11(9)15-8-10/h1-8H,(H2,14,16,17,18)
InChIKeyYLGYYBKFPGZWSF-UHFFFAOYSA-N
XLogP3.34
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,4-dichlorophenyl)-3-quinolin-3-ylurea
CID 2239305
1-(3,5-dimethoxyphenyl)-3-quinolin-3-ylurea
CID 16645779
N-[4-(1,3-thiazol-2-ylcarbamoylamino)phenyl]acetamide
CID 47148362
(E)-N-quinolin-3-yl-3-thiophen-2-ylprop-2-enamide
CID 18146464
2-chloro-N-(quinolin-3-ylcarbamoyl)acetamide
CID 62806519
1-quinolin-3-yl-3-(3,4,5-trimethoxyphenyl)urea
CID 16645769
N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide
CID 23972923
methyl N-quinolin-3-ylcarbamate
CID 19697860
1-(7-hydroxynaphthalen-1-yl)-3-(1,3-thiazol-2-yl)urea
CID 5330590
2,2,3,3-tetrafluoro-N-quinolin-3-ylpropanamide
CID 103732344
1-(3-chloro-4-hydroxyphenyl)-3-(1,3-thiazol-2-yl)urea
CID 99831962
1-(2-methoxyethyl)-3-quinolin-3-ylurea
CID 175700628

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea?
The IUPAC name of 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea (CID 47149919) is 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea.
What is the SMILES notation for 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea?
The canonical SMILES for 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea is O=C(Nc1cnc2ccccc2c1)Nc1nccs1.
What is the InChIKey of 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea?
The InChIKey is YLGYYBKFPGZWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4OS/c18-12(17-13-14-5-6-19-13)16-10-7-9-3-1-2-4-11(9)15-8-10/h1-8H,(H2,14,16,17,18).
What are the key properties of 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea?
1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea has a molecular weight of 270.32 g/mol, XLogP of 3.34, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea is sourced from PubChem (CID 47149919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).