N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide

C17H18N4O2S2 — CID 118618386

IUPACN-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N4CCNCC4)nc3s2)cc1
InChIInChI=1S/C17H18N4O2S2/c1-23-12-4-2-11(3-5-12)19-15(22)13-10-14-16(24-13)20-17(25-14)21-8-6-18-7-9-21/h2-5,10,18H,6-9H2,1H3,(H,19,22)
InChIKeyFTBSAFVXFLZDIR-UHFFFAOYSA-N
MW374.49 g/mol
LogP3.03
Rot. Bonds4

About N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide

N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618386) has the molecular formula C17H18N4O2S2 and a molecular weight of 374.49 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618386
Molecular FormulaC17H18N4O2S2
Molecular Weight374.49 g/mol
Exact Mass374.09
IUPAC NameN-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N4CCNCC4)nc3s2)cc1
InChIInChI=1S/C17H18N4O2S2/c1-23-12-4-2-11(3-5-12)19-15(22)13-10-14-16(24-13)20-17(25-14)21-8-6-18-7-9-21/h2-5,10,18H,6-9H2,1H3,(H,19,22)
InChIKeyFTBSAFVXFLZDIR-UHFFFAOYSA-N
XLogP3.03
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618386) is N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is COc1ccc(NC(=O)c2cc3sc(N4CCNCC4)nc3s2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is FTBSAFVXFLZDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2S2/c1-23-12-4-2-11(3-5-12)19-15(22)13-10-14-16(24-13)20-17(25-14)21-8-6-18-7-9-21/h2-5,10,18H,6-9H2,1H3,(H,19,22).
What are the key properties of N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 374.49 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).