3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide

C18H16N4O3S — CID 35997967

IUPAC3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc3ccccc3s2)c1
InChIInChI=1S/C18H16N4O3S/c1-10(23)19-13-7-12(8-14(9-13)20-11(2)24)17(25)22-18-21-15-5-3-4-6-16(15)26-18/h3-9H,1-2H3,(H,19,23)(H,20,24)(H,21,22,25)
InChIKeyONYPLTQHWIVEPX-UHFFFAOYSA-N
MW368.42 g/mol
LogP3.47
Rot. Bonds4

About 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide

3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide (PubChem CID 35997967) has the molecular formula C18H16N4O3S and a molecular weight of 368.42 g/mol. Its IUPAC name is 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide.

Molecular Properties

Compound Name3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide
PubChem CID35997967
Molecular FormulaC18H16N4O3S
Molecular Weight368.42 g/mol
Exact Mass368.09
IUPAC Name3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc3ccccc3s2)c1
InChIInChI=1S/C18H16N4O3S/c1-10(23)19-13-7-12(8-14(9-13)20-11(2)24)17(25)22-18-21-15-5-3-4-6-16(15)26-18/h3-9H,1-2H3,(H,19,23)(H,20,24)(H,21,22,25)
InChIKeyONYPLTQHWIVEPX-UHFFFAOYSA-N
XLogP3.47
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 53.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-diacetamido-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
CID 35983210
3,5-diamino-N-(1,3-benzothiazol-2-yl)benzamide
CID 61092934
4-amino-N-(1,3-benzothiazol-2-yl)-3,5-difluorobenzamide
CID 63187259
3,5-diacetamido-N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)benzamide
CID 37200709
N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide
CID 4233786
N-(1,3-benzothiazol-2-yl)-4-(bromomethyl)benzamide
CID 102850815
N-(1,3-benzothiazol-2-yl)-1,3-benzothiazole-2-carboxamide
CID 86264452
N-(1,3-benzothiazol-2-yl)quinoxaline-6-carboxamide
CID 2983645
N,N'-bis(1,3-benzothiazol-2-yl)oxamide
CID 591706
N-(1,3-benzothiazol-2-yl)-1-methylpyrazole-4-carboxamide
CID 35294982
N-(1,3-benzothiazol-2-yl)-3-(chloromethyl)benzamide
CID 43156362
N-(1,3-benzothiazol-2-yl)-4-propan-2-yloxybenzamide
CID 833754

Frequently Asked Questions

What is the IUPAC name of 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide?
The IUPAC name of 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide (CID 35997967) is 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide.
What is the SMILES notation for 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide?
The canonical SMILES for 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide is CC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc3ccccc3s2)c1.
What is the InChIKey of 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide?
The InChIKey is ONYPLTQHWIVEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O3S/c1-10(23)19-13-7-12(8-14(9-13)20-11(2)24)17(25)22-18-21-15-5-3-4-6-16(15)26-18/h3-9H,1-2H3,(H,19,23)(H,20,24)(H,21,22,25).
What are the key properties of 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide?
3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide has a molecular weight of 368.42 g/mol, XLogP of 3.47, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diacetamido-N-(1,3-benzothiazol-2-yl)benzamide is sourced from PubChem (CID 35997967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).