4-chloro-6-ethylthieno[2,3-d]pyrimidine

4-chloro-6-ethylthieno[2,3-d]pyrimidine

CAS: 81136-42-7

Formula: C8H7ClN2S

SMILES: CCC1=CC2=C(Cl)N=CN=C2S1

IUPAC: 4-chloro-6-ethylthieno[2,3-d]pyrimidine

InChI: InChI=1S/C8H7ClN2S/c1-2-5-3-6-7(9)10-4-11-8(6)12-5/h3-4H,2H2,1H3

Composition: C (48.37%), H (3.55%), Cl (17.84%), N (14.10%), S (16.14%)

Molar Mass: 198.67

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	198.0018471
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	IYTRSBKGPIDYHI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.46
Topological Polar Surface Area	25.78
Polarizability	19.62
Ring Count	2
Rotatable Bond Count	1

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