3-(benzenesulfonyl)-N2,5,N6,N6,7-pentamethylpyrazolo[1,5-a]pyrimidine-2,6-diamine

3-(benzenesulfonyl)-N2,5,N6,N6,7-pentamethylpyrazolo[1,5-a]pyrimidine-2,6-diamine

CAS: 1220646-23-0

Formula: C17H21N5O2S

SMILES: CNC1=NN2C(N=C(C)C(N(C)C)=C2C)=C1S(=O)(=O)C1=CC=CC=C1

IUPAC: 3-(benzenesulfonyl)-N2,5,N6,N6,7-pentamethylpyrazolo[1,5-a]pyrimidine-2,6-diamine

InChI: InChI=1S/C17H21N5O2S/c1-11-14(21(4)5)12(2)22-17(19-11)15(16(18-3)20-22)25(23,24)13-9-7-6-8-10-13/h6-10H,1-5H3,(H,18,20)

Composition: C (56.81%), H (5.89%), N (19.48%), O (8.90%), S (8.92%)

Molar Mass: 359.45

Atom Count: 46

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	359.14159611
Formal Charge	0
FSP3	0.29
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	SNPPEHMSSOEYDH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.98
Topological Polar Surface Area	79.6
Polarizability	37.79
Ring Count	3
Rotatable Bond Count	4

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