(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

C10H10N2S — CID 58581889

IUPAC(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
SMILESC[C@H]1CN2C(=N1)Sc1ccccc12
InChIInChI=1S/C10H10N2S/c1-7-6-12-8-4-2-3-5-9(8)13-10(12)11-7/h2-5,7H,6H2,1H3/t7-/m0/s1
InChIKeyYMNLZZPPRDWZQH-ZETCQYMHSA-N
MW190.27 g/mol
LogP2.36
Rot. Bonds

About (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole (PubChem CID 58581889) has the molecular formula C10H10N2S and a molecular weight of 190.27 g/mol. Its IUPAC name is (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
PubChem CID58581889
Molecular FormulaC10H10N2S
Molecular Weight190.27 g/mol
Exact Mass190.06
IUPAC Name(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
SMILESC[C@H]1CN2C(=N1)Sc1ccccc12
InChIInChI=1S/C10H10N2S/c1-7-6-12-8-4-2-3-5-9(8)13-10(12)11-7/h2-5,7H,6H2,1H3/t7-/m0/s1
InChIKeyYMNLZZPPRDWZQH-ZETCQYMHSA-N
XLogP2.36
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Dihydroimidazo(2,1-b)benzothiazol-6-amine
CID 658687
3-Methyl-2-benzothiazolone hydrazone hydrochloride
CID 9575839
3-methylbenzothiazol-2(3H)-one hydrazone
CID 14319
3-Methyl-2-benzothiazolinone hydrazone hydrochloride
CID 78041
3-Methyl-1,3-benzothiazol-2(3H)-imine
CID 84642
(2S)-2-Phenyl-2,3-dihydroimidazo(2,1-b)(1,3)benzothiazole
CID 17747785
3-Methyl-2-benzothiazolone hydrazone
CID 5782694
(NE)-N-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]hydroxylamine
CID 5405669
3-Methyl-2-benzothiazolinone hydrazone hydrochloride monohydrate
CID 6364530
(1E)-1-(3-methyl-1,3-benzothiazol-2-ylidene)-3-prop-2-enylthiourea
CID 5754122
N-(3-methyl-1,3-benzothiazol-2-ylidene)acetamide
CID 656374
3-Methyl-2-benzothiazolinone hydrazone
CID 5359575

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole (CID 58581889) is (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole is C[C@H]1CN2C(=N1)Sc1ccccc12.
What is the InChIKey of (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The InChIKey is YMNLZZPPRDWZQH-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H10N2S/c1-7-6-12-8-4-2-3-5-9(8)13-10(12)11-7/h2-5,7H,6H2,1H3/t7-/m0/s1.
What are the key properties of (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
(2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole has a molecular weight of 190.27 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 58581889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).