Chemical Properties of Formamide, n-[4-amino-2,6-bis-(methylthio)-5-pyrimidinyl]- (CAS 7595-53-1)

Formamide, n-[4-amino-2,6-bis-(methylthio)-5-pyrimidinyl]-

InChI
InChI=1S/C7H10N4OS2/c1-13-6-4(9-3-12)5(8)10-7(11-6)14-2/h3H,1-2H3,(H,9,12)(H2,8,10,11)
InChI Key
YLYJQBRXRIAMIN-UHFFFAOYSA-N
Formula
C7H10N4OS2
SMILES
CSc1nc(N)c(NC=O)c(SC)n1
Molecular Weight1
230.31
CAS
7595-53-1
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Physical Properties

Property Value Unit Source
ω 0.6350 Relay (1.0) Calculated Property
ΔfG° 223.12 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 6.61 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 104.27 kJ/mol Relay (1.0) Calculated Property
IE 7.91 eV Relay (1.0) Calculated Property
log10WS -2.54 Relay (1.0) Calculated Property
logPoct/wat 1.071 Crippen Calculated Property
McVol 159.920 ml/mol McGowan Calculated Property
Pc 4287.55 kPa Relay (1.0-beta) Calculated Property
Tboil 609.90 K Relay (1.0) Calculated Property
Tc 945.20 K Relay (1.0) Calculated Property
Tfus 425.98 K Relay (1.0) Calculated Property
Vc 0.532 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Formamide, n-[4-amino-6-(benzylthio)-5-pyrimidinyl]-n-benzyl-. Formamide, n-(4-amino-6-(benzylthio)-5-pyrimidinyl)-n-ethyl-. 5-Hydroxytryptophan, methyl, 2-PFP. 2'-Deoxyadenosine, N-trimethylsilyl-, bis(trimethylsilyl) ether. 5-Hydroxytryptophan, methyl, 3-PFP. pimaricin. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 5-methyluridine, 2',3',5'-tris(O-TMSi). propyl-«delta»1-tetrahydrocannabinolic acid, TMS. «delta»1-tetrahydrocannabinolic acid, TMS. 5-Methyluridine, tris(trimethylsilyl) deriv.. Lysergol. 2'-Deoxyadenosine, 3',5',N6-tris(O-TBDMSi). Thymidine, 3',5'-bis-O-TMS. N6-TMS-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS.

Find more compounds similar to Formamide, n-[4-amino-2,6-bis-(methylthio)-5-pyrimidinyl]-.

Sources

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