(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone

C24H21N3O2S — CID 10251285

IUPAC(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone
SMILESO=C(c1c[nH]c2cc(OCc3ccccc3)ccc12)[C@@H]1CSC(c2cccnc2)N1
InChIInChI=1S/C24H21N3O2S/c28-23(22-15-30-24(27-22)17-7-4-10-25-12-17)20-13-26-21-11-18(8-9-19(20)21)29-14-16-5-2-1-3-6-16/h1-13,22,24,26-27H,14-15H2/t22-,24?/m0/s1
InChIKeyPQKFTEXJAARLFZ-OWJIYDKWSA-N
MW415.52 g/mol
LogP4.73
Rot. Bonds6

About (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone

(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone (PubChem CID 10251285) has the molecular formula C24H21N3O2S and a molecular weight of 415.52 g/mol. Its IUPAC name is (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone.

Molecular Properties

Compound Name(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone
PubChem CID10251285
Molecular FormulaC24H21N3O2S
Molecular Weight415.52 g/mol
Exact Mass415.14
IUPAC Name(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone
SMILESO=C(c1c[nH]c2cc(OCc3ccccc3)ccc12)[C@@H]1CSC(c2cccnc2)N1
InChIInChI=1S/C24H21N3O2S/c28-23(22-15-30-24(27-22)17-7-4-10-25-12-17)20-13-26-21-11-18(8-9-19(20)21)29-14-16-5-2-1-3-6-16/h1-13,22,24,26-27H,14-15H2/t22-,24?/m0/s1
InChIKeyPQKFTEXJAARLFZ-OWJIYDKWSA-N
XLogP4.73
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.52
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone with MolForge

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Related Compounds

4-(benzyloxy)-1H-indole-3-carbaldehyde
CID 7015846
Arenarine C
CID 188439
5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl}-2,3-dihydro-1H-indole-2,3-dione
CID 23647542
1-(6-methoxy-1H-indol-3-yl)-2-thiomorpholin-4-ylethanone
CID 944731
Bis(1H-2-indolyl)methanone deriv. 72
CID 5330566
6-Benzyloxy-3-((R)-2-pyridin-3-yl-thiazolidine-4-carbonyl)-indole-1-carboxylic acid tert-butyl ester
CID 11756259
(7-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone;2,2,2-trifluoroacetic acid
CID 44304416
1-(4-benzoylpiperazin-1-yl)-2-(6-methoxy-1H-indol-3-yl)ethane-1,2-dione
CID 506225
2-(1H-indol-3-yl)-N-(3-methoxyphenyl)-2-oxoacetamide
CID 5300155
(6-methoxy-1H-indol-3-yl)(2-(quinolin-6-ylmethylamino)phenyl)methanone
CID 44577878
1-(1H-indol-3-yl)-2-phenyl-2-((3-(trifluoromethoxy)phenyl)amino)ethanone
CID 71542742
1-(1H-indol-3-yl)-2-((3-methoxyphenyl)amino)-2-(pyridin-3-yl)ethanone
CID 71542830

Frequently Asked Questions

What is the IUPAC name of (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone?
The IUPAC name of (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone (CID 10251285) is (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone.
What is the SMILES notation for (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone?
The canonical SMILES for (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone is O=C(c1c[nH]c2cc(OCc3ccccc3)ccc12)[C@@H]1CSC(c2cccnc2)N1.
What is the InChIKey of (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone?
The InChIKey is PQKFTEXJAARLFZ-OWJIYDKWSA-N. The full InChI is InChI=1S/C24H21N3O2S/c28-23(22-15-30-24(27-22)17-7-4-10-25-12-17)20-13-26-21-11-18(8-9-19(20)21)29-14-16-5-2-1-3-6-16/h1-13,22,24,26-27H,14-15H2/t22-,24?/m0/s1.
What are the key properties of (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone?
(6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone has a molecular weight of 415.52 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-phenylmethoxy-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone is sourced from PubChem (CID 10251285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).