1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea

C14H11N5O2S — CID 18771602

IUPAC1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
SMILESO=C(Nc1csc(-c2cccnc2)n1)Nc1ncccc1O
InChIInChI=1S/C14H11N5O2S/c20-10-4-2-6-16-12(10)19-14(21)18-11-8-22-13(17-11)9-3-1-5-15-7-9/h1-8,20H,(H2,16,18,19,21)
InChIKeyLWHNIINZEBZVOM-UHFFFAOYSA-N
MW313.34 g/mol
LogP2.95
Rot. Bonds3

About 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea

1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea (PubChem CID 18771602) has the molecular formula C14H11N5O2S and a molecular weight of 313.34 g/mol. Its IUPAC name is 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea.

Molecular Properties

Compound Name1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
PubChem CID18771602
Molecular FormulaC14H11N5O2S
Molecular Weight313.34 g/mol
Exact Mass313.06
IUPAC Name1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
SMILESO=C(Nc1csc(-c2cccnc2)n1)Nc1ncccc1O
InChIInChI=1S/C14H11N5O2S/c20-10-4-2-6-16-12(10)19-14(21)18-11-8-22-13(17-11)9-3-1-5-15-7-9/h1-8,20H,(H2,16,18,19,21)
InChIKeyLWHNIINZEBZVOM-UHFFFAOYSA-N
XLogP2.95
TPSA100.03 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.34
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-pyridin-3-yl-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
CID 18772022
1-(4-phenyl-1,3-thiazol-2-yl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
CID 18771890
1-(3-tert-butyl-1λ3-ioda-2-oxacyclopenta-3,5-dien-5-yl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea
CID 163640903
(2S)-2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)amino]propanoic acid
CID 151833178
bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
CID 175265157
N-hydroxy-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 604917
N-(3-hydroxy-2-pyridinyl)-2-(4-methylphenyl)-1,3-thiazole-4-carboxamide
CID 18109513
1-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanone
CID 22888692
1-(6-bromo-2-pyridinyl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)urea
CID 23109079
1-(6-methyl-2-pyridinyl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)urea
CID 18771694
1-(2-pyridin-4-yl-1,3-thiazol-4-yl)-3-(4-pyridin-2-yl-1,3-thiazol-2-yl)urea
CID 58824766
4-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 119088487

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea?
The IUPAC name of 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea (CID 18771602) is 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea.
What is the SMILES notation for 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea?
The canonical SMILES for 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea is O=C(Nc1csc(-c2cccnc2)n1)Nc1ncccc1O.
What is the InChIKey of 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea?
The InChIKey is LWHNIINZEBZVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2S/c20-10-4-2-6-16-12(10)19-14(21)18-11-8-22-13(17-11)9-3-1-5-15-7-9/h1-8,20H,(H2,16,18,19,21).
What are the key properties of 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea?
1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea has a molecular weight of 313.34 g/mol, XLogP of 2.95, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxy-2-pyridinyl)-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)urea is sourced from PubChem (CID 18771602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).