4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride

C18H17ClN4OS — CID 162425813

IUPAC4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCl.[2H]C([2H])([2H])Oc1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)cc1
InChIInChI=1S/C18H16N4OS.ClH/c1-12-17(22-10-4-3-5-16(22)19-12)15-11-24-18(21-15)20-13-6-8-14(23-2)9-7-13;/h3-11H,1-2H3,(H,20,21);1H/i2D3;
InChIKeyDSBMTRCOQIONJX-MUTAZJQDSA-N
MW375.90 g/mol
LogP4.94
Rot. Bonds5

About 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride

4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride (PubChem CID 162425813) has the molecular formula C18H17ClN4OS and a molecular weight of 375.90 g/mol. Its IUPAC name is 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride
PubChem CID162425813
Molecular FormulaC18H17ClN4OS
Molecular Weight375.90 g/mol
Exact Mass375.10
IUPAC Name4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCl.[2H]C([2H])([2H])Oc1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)cc1
InChIInChI=1S/C18H16N4OS.ClH/c1-12-17(22-10-4-3-5-16(22)19-12)15-11-24-18(21-15)20-13-6-8-14(23-2)9-7-13;/h3-11H,1-2H3,(H,20,21);1H/i2D3;
InChIKeyDSBMTRCOQIONJX-MUTAZJQDSA-N
XLogP4.94
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.90
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)thiazol-2-amine
CID 1117196
JK184
CID 1069686
N-(4-methoxyphenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide
CID 6618978
9-butyl-8-[(7-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-9H-purin-6-amine
CID 11850635
3-[[4-(2-Methylimidazo[1,2-a]pyridin-3-yl)-2-thiazolyl]amino]phenol
CID 3128426
N-(2-aminoethyl)-4-(2-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093435
N-(2-aminoethyl)-4-(3-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093436
N-(2-aminoethyl)-4-(4-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093437
N-[3-(1H-imidazol-1-yl)propyl]-6-methoxy-1,3-benzothiazol-2-amine
CID 6539205
1-[5-(5-methoxy-3-pyridinyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]-3-[2-(1-propylimidazol-4-yl)ethyl]urea
CID 122180516
N-(4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 667521
4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 2877432

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride (CID 162425813) is 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride is Cl.[2H]C([2H])([2H])Oc1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)cc1.
What is the InChIKey of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is DSBMTRCOQIONJX-MUTAZJQDSA-N. The full InChI is InChI=1S/C18H16N4OS.ClH/c1-12-17(22-10-4-3-5-16(22)19-12)15-11-24-18(21-15)20-13-6-8-14(23-2)9-7-13;/h3-11H,1-2H3,(H,20,21);1H/i2D3;.
What are the key properties of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride?
4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 375.90 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trideuteriomethoxy)phenyl]-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 162425813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).