4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine

C24H27N7O3S — CID 56966914

IUPAC4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nc(-c3cccc4[nH]ncc34)cn2c1C1=CCN(S(C)(=O)=O)CC1
InChIInChI=1S/C24H27N7O3S/c1-16-22(17-6-8-30(9-7-17)35(2,32)33)31-15-21(18-4-3-5-20-19(18)14-25-28-20)27-23(24(31)26-16)29-10-12-34-13-11-29/h3-6,14-15H,7-13H2,1-2H3,(H,25,28)
InChIKeyADIAWJJDXUSKEJ-UHFFFAOYSA-N
MW493.59 g/mol
LogP2.47
Rot. Bonds4

About 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine

4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine (PubChem CID 56966914) has the molecular formula C24H27N7O3S and a molecular weight of 493.59 g/mol. Its IUPAC name is 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
PubChem CID56966914
Molecular FormulaC24H27N7O3S
Molecular Weight493.59 g/mol
Exact Mass493.19
IUPAC Name4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nc(-c3cccc4[nH]ncc34)cn2c1C1=CCN(S(C)(=O)=O)CC1
InChIInChI=1S/C24H27N7O3S/c1-16-22(17-6-8-30(9-7-17)35(2,32)33)31-15-21(18-4-3-5-20-19(18)14-25-28-20)27-23(24(31)26-16)29-10-12-34-13-11-29/h3-6,14-15H,7-13H2,1-2H3,(H,25,28)
InChIKeyADIAWJJDXUSKEJ-UHFFFAOYSA-N
XLogP2.47
TPSA108.72 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.59
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 56966913
4-[6-(1H-indazol-4-yl)-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-[1,2,4]triazolo[1,5-a]pyrazin-8-yl]morpholine
CID 53353753
4-[5-chloro-6-(1H-indazol-4-yl)-2-[(4-methylsulfonylpiperazin-1-yl)methyl]imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 57396608
6-(1H-indazol-4-yl)-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-8-morpholin-4-ylimidazo[1,2-a]pyrazine-5-carbonitrile
CID 57401846
4-[2-(1H-indazol-4-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]-1-methylsulfonylpiperidin-4-ol
CID 59592875
8-[[6-(1H-indazol-4-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 90067971
4-[2-(1H-indazol-4-yl)-6-[1-(4-methylsulfonylpiperazin-1-yl)ethyl]thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 59593168
4-[2-(3,9-diazaspiro[5.5]undecan-3-ylmethyl)-6-(1H-indazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 90067975
4-[6-(1H-indazol-4-yl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]morpholine
CID 66749609
5-(5-methylsulfonyl-10-morpholin-4-yl-1,5,8,11-tetrazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraen-12-yl)pyrimidin-2-amine
CID 52917534
4-[2-(1H-indazol-4-yl)-9-(2-methoxyethyl)-8-[(4-methylsulfonylpiperazin-1-yl)methyl]purin-6-yl]morpholine
CID 44543871
N-[2-[2-(1H-indazol-4-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]propan-2-yl]methanesulfonamide
CID 59593040

Frequently Asked Questions

What is the IUPAC name of 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The IUPAC name of 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine (CID 56966914) is 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine.
What is the SMILES notation for 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The canonical SMILES for 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine is Cc1nc2c(N3CCOCC3)nc(-c3cccc4[nH]ncc34)cn2c1C1=CCN(S(C)(=O)=O)CC1.
What is the InChIKey of 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The InChIKey is ADIAWJJDXUSKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N7O3S/c1-16-22(17-6-8-30(9-7-17)35(2,32)33)31-15-21(18-4-3-5-20-19(18)14-25-28-20)27-23(24(31)26-16)29-10-12-34-13-11-29/h3-6,14-15H,7-13H2,1-2H3,(H,25,28).
What are the key properties of 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine has a molecular weight of 493.59 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(1H-indazol-4-yl)-2-methyl-3-(1-methylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine is sourced from PubChem (CID 56966914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).