1B3

N-{[3-(4-amino-2-chloroquinazolin-7-yl)phenyl]sulfonyl}-L-threoninamide


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Chemical Component Summary

NameN-{[3-(4-amino-2-chloroquinazolin-7-yl)phenyl]sulfonyl}-L-threoninamide
Identifiers(2S,3R)-2-azanyl-N-[3-(4-azanyl-2-chloranyl-quinazolin-7-yl)phenyl]sulfonyl-3-oxidanyl-butanamide
FormulaC18 H18 Cl N5 O4 S
Molecular Weight435.885
TypeNON-POLYMER
Isomeric SMILESC[C@H]([C@@H](C(=O)NS(=O)(=O)c1cccc(c1)c2ccc3c(c2)nc(nc3N)Cl)N)O
InChIInChI=1S/C18H18ClN5O4S/c1-9(25)15(20)17(26)24-29(27,28)12-4-2-3-10(7-12)11-5-6-13-14(8-11)22-18(19)23-16(13)21/h2-9,15,25H,20H2,1H3,(H,24,26)(H2,21,22,23)/t9-,15+/m1/s1
InChIKeyMSFGWBJSNPMREF-PSLIRLAXSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count2
Bond Count49
Aromatic Bond Count17

Related Resource References

Resource NameReference
Pharos CHEMBL2311920
PubChem 71574476
ChEMBL CHEMBL2311920