Name: Name:5,6-diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
Brand: Angene
SKU: AG01BV4A
Rating: 90 (10 reviews)

5,6-diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

CAS No.:

875-41-2

Catalog Number:

AG01BV4A

Molecular Formula:

C5H8N4OS

Molecular Weight:

172.2082

Catalog Number:

AG01BV4A

Chemical Name:

5,6-diamino-1-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

CAS Number:

875-41-2

Molecular Formula:

C5H8N4OS

Molecular Weight:

172.2082

MDL Number:

MFCD00154747

IUPAC Name:

5,6-diamino-1-methyl-2-sulfanylidenepyrimidin-4-one

InChI:

InChI=1S/C5H8N4OS/c1-9-3(7)2(6)4(10)8-5(9)11/h6-7H2,1H3,(H,8,10,11)

InChI Key:

UUTGBPJLMXTUQE-UHFFFAOYSA-N

SMILES:

O=c1[nH]c(=S)n(c(c1N)N)C

NSC Number:

43407

Complexity:

259

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.206g/mol

Monoisotopic Mass:

172.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

117A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.1