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N-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)thieno[3,2-d]pyrimidin-4-amine

N-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)thieno[3,2-d]pyrimidin-4-amine

CAS: 478067-59-3

Formula: C12H13N3S2

SMILES: C=CCNC1=C2SC=CC2=NC(SCC=C)=N1

IUPAC: N-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)thieno[3,2-d]pyrimidin-4-amine

InChI: InChI=1S/C12H13N3S2/c1-3-6-13-11-10-9(5-8-16-10)14-12(15-11)17-7-4-2/h3-5,8H,1-2,6-7H2,(H,13,14,15)

Composition: C (54.72%), H (4.98%), N (15.95%), S (24.35%)

Molar Mass: 263.38

Atom Count: 30

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 263.055089779
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HQKDZYIVSFPCKJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.28
Topological Polar Surface Area 37.81
Polarizability 29.5
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 478067-59-3 $51.35-$86.31$51.35$63.37$86.31
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