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[(2-carbamimidamido-1,3-thiazol-4-yl)methyl]sulfanylmethanimidamide hydrochloride

[(2-carbamimidamido-1,3-thiazol-4-yl)methyl]sulfanylmethanimidamide hydrochloride

CAS: 88046-01-9

Formula: C6H11ClN6S2

SMILES: Cl.NC(=N)NC1=NC(CSC(N)=N)=CS1

IUPAC: {[(2-carbamimidamido-1,3-thiazol-4-yl)methyl]sulfanyl}methanimidamide hydrochloride

InChI: InChI=1S/C6H10N6S2.ClH/c7-4(8)12-6-11-3(2-14-6)1-13-5(9)10;/h2H,1H2,(H3,9,10)(H4,7,8,11,12);1H

Composition: C (27.01%), H (4.16%), Cl (13.29%), N (31.50%), S (24.04%)

Molar Mass: 266.77

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 266.0175144
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 5
InChIKey DMXJVYCDETXZRR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.03
Topological Polar Surface Area 124.66
Polarizability 21.67
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 88046-01-9 $444.00$444.00
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