N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide

C17H12N2O4S — CID 25162210

IUPACN-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)o1
InChIInChI=1S/C17H12N2O4S/c1-10-6-7-13(23-10)16(20)19-17-18-14(11-4-2-8-21-11)15(24-17)12-5-3-9-22-12/h2-9H,1H3,(H,18,19,20)
InChIKeyUFGQUYLYUCAEBB-UHFFFAOYSA-N
MW340.36 g/mol
LogP4.82
Rot. Bonds4

About N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide

N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide (PubChem CID 25162210) has the molecular formula C17H12N2O4S and a molecular weight of 340.36 g/mol. Its IUPAC name is N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide
PubChem CID25162210
Molecular FormulaC17H12N2O4S
Molecular Weight340.36 g/mol
Exact Mass340.05
IUPAC NameN-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)o1
InChIInChI=1S/C17H12N2O4S/c1-10-6-7-13(23-10)16(20)19-17-18-14(11-4-2-8-21-11)15(24-17)12-5-3-9-22-12/h2-9H,1H3,(H,18,19,20)
InChIKeyUFGQUYLYUCAEBB-UHFFFAOYSA-N
XLogP4.82
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

A1/A3 AR antagonist 2
CID 162673862
N-[4-thiophen-2-yl-5-(2,2,2-trifluoroacetyl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 4197372
Bis(furan-2-yl)-1,3-thiazol-2-amine
CID 2428993
(4-(Furan-2-yl)-2-(furan-2-ylmethylamino)thiazol-5-yl)(phenyl)methanone
CID 25211167
2-Amino-5-(2-furanyl)-4-[2-(5-phosphono)furanyl]thiazole
CID 50992650
Ethyl 2-(furan-2-carboxamido)-4-phenylthiazole-5-carboxylate
CID 747391
Ethyl 4-methyl-2-[(5-methylfuran-2-carbonyl)amino]-1,3-thiazole-5-carboxylate
CID 868243
N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 2115891
N-[bis(furan-2-yl)-1,3-thiazol-2-yl]-2-chloroacetamide
CID 2385998
N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 5033052
N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]pyrazine-2-carboxamide
CID 7998465
N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 7998972

Frequently Asked Questions

What is the IUPAC name of N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide?
The IUPAC name of N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide (CID 25162210) is N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide?
The canonical SMILES for N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)o1.
What is the InChIKey of N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide?
The InChIKey is UFGQUYLYUCAEBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O4S/c1-10-6-7-13(23-10)16(20)19-17-18-14(11-4-2-8-21-11)15(24-17)12-5-3-9-22-12/h2-9H,1H3,(H,18,19,20).
What are the key properties of N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide?
N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide has a molecular weight of 340.36 g/mol, XLogP of 4.82, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4,5-bis(furan-2-yl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 25162210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).