6-Sec-Butoxy-2-[(3-Chlorophenyl)sulfanyl]-4-Pyrimidinamine
6-[(2R)-butan-2-yl]oxy-2-(3-chlorophenyl)sulfanylpyrimidin-4-amine
Molecular Identity
6-Sec-Butoxy-2-[(3-Chlorophenyl)sulfanyl]-4-Pyrimidinamine
6-[(2R)-butan-2-yl]oxy-2-(3-chlorophenyl)sulfanylpyrimidin-4-amine
PubChem CID: 122197558
2D Structure
Properties
C14H16ClN3OS
Molecular Formula
309.80
Molecular Weight
g/mol
309.0703
Exact Mass
Da
4.5
XLogP
Drug-like (Lipinski: < 5)
86.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
298
Complexity
SMILES
Canonical SMILES
SMILES: CCC(C)OC1=NC(=NC(=C1)N)SC2=CC(=CC=C2)ClIsomeric SMILES
SMILES: CC[C@@H](C)OC1=NC(=NC(=C1)N)SC2=CC(=CC=C2)ClSynonyms(2)
6-Sec-Butoxy-2-[(3-Chlorophenyl)sulfanyl]-4-PyrimidinamineRDS
Data from PubChem (NCBI)
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Molecular Structure
6-Sec-Butoxy-2-[(3-Chlorophenyl)sulfanyl]-4-Pyrimidinamine
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Drug Network
Trials and conditions connected to 6-Sec-Butoxy-2-[(3-Chlorophenyl)sulfanyl]-4-Pyrimidinamine
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