2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide

C19H19N3O3S — CID 16555624

IUPAC2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide
SMILESCOCCn1c(-c2ccc(O)c(C(N)=O)c2)cs/c1=N\c1ccccc1
InChIInChI=1S/C19H19N3O3S/c1-25-10-9-22-16(13-7-8-17(23)15(11-13)18(20)24)12-26-19(22)21-14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3,(H2,20,24)/b21-19-
InChIKeyALWXWZPQIVPVOE-VZCXRCSSSA-N
MW369.45 g/mol
LogP2.90
Rot. Bonds6

About 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide

2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide (PubChem CID 16555624) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide
PubChem CID16555624
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC Name2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide
SMILESCOCCn1c(-c2ccc(O)c(C(N)=O)c2)cs/c1=N\c1ccccc1
InChIInChI=1S/C19H19N3O3S/c1-25-10-9-22-16(13-7-8-17(23)15(11-13)18(20)24)12-26-19(22)21-14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3,(H2,20,24)/b21-19-
InChIKeyALWXWZPQIVPVOE-VZCXRCSSSA-N
XLogP2.90
TPSA89.84 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiaz_ene_A(128)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide?
The IUPAC name of 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide (CID 16555624) is 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide.
What is the SMILES notation for 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide?
The canonical SMILES for 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide is COCCn1c(-c2ccc(O)c(C(N)=O)c2)cs/c1=N\c1ccccc1.
What is the InChIKey of 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide?
The InChIKey is ALWXWZPQIVPVOE-VZCXRCSSSA-N. The full InChI is InChI=1S/C19H19N3O3S/c1-25-10-9-22-16(13-7-8-17(23)15(11-13)18(20)24)12-26-19(22)21-14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3,(H2,20,24)/b21-19-.
What are the key properties of 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide?
2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide has a molecular weight of 369.45 g/mol, XLogP of 2.90, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-[3-(2-methoxyethyl)-2-phenylimino-1,3-thiazol-4-yl]benzamide is sourced from PubChem (CID 16555624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).