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4-amino-5-methyl-N-(4-methylphenyl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxamide

4-amino-5-methyl-N-(4-methylphenyl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxamide

Formula: C21H18N4OS

SMILES: CC1=C(SC2=NC(=NC(N)=C12)C1=CC=CC=C1)C(=O)NC1=CC=C(C)C=C1

IUPAC: 4-amino-5-methyl-N-(4-methylphenyl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxamide

InChI: InChI=1S/C21H18N4OS/c1-12-8-10-15(11-9-12)23-20(26)17-13(2)16-18(22)24-19(25-21(16)27-17)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,23,26)(H2,22,24,25)

Composition: C (67.36%), H (4.85%), N (14.96%), O (4.27%), S (8.56%)

Molar Mass: 374.46

Atom Count: 45

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 374.12013239
Formal Charge 0
FSP3 0.1
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JZSVOHNNMVYRGE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 121.84
Topological Polar Surface Area 80.9
Polarizability 41.63
Ring Count 4
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H18N4OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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