3-chloro-5-cyclopropylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

3-chloro-5-cyclopropylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

CAS: 1011354-08-7

Formula: C10H8ClN3O2

SMILES: OC(=O)C1=CC(=NC2=C(Cl)C=NN12)C1CC1

IUPAC: 3-chloro-5-cyclopropylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

InChI: InChI=1S/C10H8ClN3O2/c11-6-4-12-14-8(10(15)16)3-7(5-1-2-5)13-9(6)14/h3-5H,1-2H2,(H,15,16)

Composition: C (50.54%), H (3.39%), Cl (14.92%), N (17.68%), O (13.46%)

Molar Mass: 237.64

Atom Count: 24

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.0305042
Formal Charge	0
FSP3	0.3
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	SKFIYQDQYNNIIY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.7
Topological Polar Surface Area	67.49
Polarizability	21.5
Ring Count	3
Rotatable Bond Count	2

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