5H-indolo[3,2-b][1,5]benzothiazepine

C15H10N2S — CID 22169826

IUPAC5H-indolo[3,2-b][1,5]benzothiazepine
SMILESC1=Nc2ccccc2Sc2c1[nH]c1ccccc21
InChIInChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-13(17-11)9-16-12-7-3-4-8-14(12)18-15/h1-9,17H
InChIKeyRWHZLSHOGJONCU-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.38
Rot. Bonds

About 5H-indolo[3,2-b][1,5]benzothiazepine

5H-indolo[3,2-b][1,5]benzothiazepine (PubChem CID 22169826) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 5H-indolo[3,2-b][1,5]benzothiazepine.

Molecular Properties

Compound Name5H-indolo[3,2-b][1,5]benzothiazepine
PubChem CID22169826
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name5H-indolo[3,2-b][1,5]benzothiazepine
SMILESC1=Nc2ccccc2Sc2c1[nH]c1ccccc21
InChIInChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-13(17-11)9-16-12-7-3-4-8-14(12)18-15/h1-9,17H
InChIKeyRWHZLSHOGJONCU-UHFFFAOYSA-N
XLogP4.38
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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bromomethane;9H-carbazole
CID 67594562
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CID 158299126
1,9-dihydropyrido[3,4-b]indol-1-ide;iridium
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Frequently Asked Questions

What is the IUPAC name of 5H-indolo[3,2-b][1,5]benzothiazepine?
The IUPAC name of 5H-indolo[3,2-b][1,5]benzothiazepine (CID 22169826) is 5H-indolo[3,2-b][1,5]benzothiazepine.
What is the SMILES notation for 5H-indolo[3,2-b][1,5]benzothiazepine?
The canonical SMILES for 5H-indolo[3,2-b][1,5]benzothiazepine is C1=Nc2ccccc2Sc2c1[nH]c1ccccc21.
What is the InChIKey of 5H-indolo[3,2-b][1,5]benzothiazepine?
The InChIKey is RWHZLSHOGJONCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-13(17-11)9-16-12-7-3-4-8-14(12)18-15/h1-9,17H.
What are the key properties of 5H-indolo[3,2-b][1,5]benzothiazepine?
5H-indolo[3,2-b][1,5]benzothiazepine has a molecular weight of 250.33 g/mol, XLogP of 4.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-indolo[3,2-b][1,5]benzothiazepine is sourced from PubChem (CID 22169826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).