(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone

C22H19N3OS — CID 27446583

IUPAC(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
SMILESCc1ccn2cc(C(=O)N3CCc4sccc4[C@@H]3c3ccccc3)nc2c1
InChIInChI=1S/C22H19N3OS/c1-15-7-10-24-14-18(23-20(24)13-15)22(26)25-11-8-19-17(9-12-27-19)21(25)16-5-3-2-4-6-16/h2-7,9-10,12-14,21H,8,11H2,1H3/t21-/m0/s1
InChIKeyOHFBTSHYUQLRSM-NRFANRHFSA-N
MW373.48 g/mol
LogP4.49
Rot. Bonds2

About (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone

(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (PubChem CID 27446583) has the molecular formula C22H19N3OS and a molecular weight of 373.48 g/mol. Its IUPAC name is (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone.

Molecular Properties

Compound Name(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
PubChem CID27446583
Molecular FormulaC22H19N3OS
Molecular Weight373.48 g/mol
Exact Mass373.12
IUPAC Name(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
SMILESCc1ccn2cc(C(=O)N3CCc4sccc4[C@@H]3c3ccccc3)nc2c1
InChIInChI=1S/C22H19N3OS/c1-15-7-10-24-14-18(23-20(24)13-15)22(26)25-11-8-19-17(9-12-27-19)21(25)16-5-3-2-4-6-16/h2-7,9-10,12-14,21H,8,11H2,1H3/t21-/m0/s1
InChIKeyOHFBTSHYUQLRSM-NRFANRHFSA-N
XLogP4.49
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone with MolForge

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Related Compounds

(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-quinoxalin-2-ylmethanone
CID 46565494
(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methanone
CID 55685749
furan-2-yl-[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 26004409
1-methyl-5-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl]pyridin-2-one
CID 138556110
(4-bromophenyl)-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methanone
CID 21264434
(2-fluorophenyl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 9451372
(2-chloro-4-pyridinyl)-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methanone
CID 46546069
(3-methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 33171337
(2,4-difluorophenyl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 41130082
(5,6-dichloro-3-pyridinyl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 9245818
4-methyl-3-[4-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]-1H-imidazol-2-one
CID 55986211
1-[(4R)-4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2,2-diphenylethanone
CID 7416702

Frequently Asked Questions

What is the IUPAC name of (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone?
The IUPAC name of (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (CID 27446583) is (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone.
What is the SMILES notation for (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone?
The canonical SMILES for (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone is Cc1ccn2cc(C(=O)N3CCc4sccc4[C@@H]3c3ccccc3)nc2c1.
What is the InChIKey of (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone?
The InChIKey is OHFBTSHYUQLRSM-NRFANRHFSA-N. The full InChI is InChI=1S/C22H19N3OS/c1-15-7-10-24-14-18(23-20(24)13-15)22(26)25-11-8-19-17(9-12-27-19)21(25)16-5-3-2-4-6-16/h2-7,9-10,12-14,21H,8,11H2,1H3/t21-/m0/s1.
What are the key properties of (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone?
(7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone has a molecular weight of 373.48 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methylimidazo[1,2-a]pyridin-2-yl)-[(4S)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone is sourced from PubChem (CID 27446583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).