Compound C18H18N2OS

2-methyl-3-(4-methylphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

CAS: 34387-07-0

Molecular Formula	`C18H18N2OS`
Molecular Weight	310.4 g/mol
LogP	4.0
Topological Polar Surface Area	60.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	310.11398
Heavy Atoms	22
Complexity	483.0

Chemical Identifiers

CAS Number	34387-07-0
SMILES	`CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C4=C(S3)CCCC4)C`
InChIKey	`YRWWUTIFTAESJM-UHFFFAOYSA-N`

📖 Product Overview

Compound C18H18N2OS (CAS: 34387-07-0) is a chemical compound with molecular formula C18H18N2OS and molecular weight 310.4 g/mol. Its IUPAC systematic name is 2-methyl-3-(4-methylphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one. LogP 4.0 Topological Polar Surface Area 60.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 1 Exact Mass 310.11398 Heavy Atoms 22 Complexity 483.0 InChI Key: YRWWUTIFTAESJM-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C4=C(S3)CCCC4)C.

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