4Sc-203
1-(2-methoxy-5-methylphenyl)-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea
Molecular Identity
4Sc-203
1-(2-methoxy-5-methylphenyl)-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea
PubChem CID: 44467821
2D Structure
Properties
C33H38N8O4S
Molecular Formula
642.80
Molecular Weight
g/mol
642.2737
Exact Mass
Da
5.3
XLogP
Above Lipinski threshold
154
TPSA
May have limited oral absorption
3
H-Bond Donors
11
H-Bond Acceptors
963
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=C(C=C1)OC)NC(=O)NC2=NC3=C(S2)C=C(C=C3)NC4=NC=NC5=CC(=C(C=C54)OC)OCCCN6CCN(CC6)CIsomeric SMILES
SMILES: CC1=CC(=C(C=C1)OC)NC(=O)NC2=NC3=C(S2)C=C(C=C3)NC4=NC=NC5=CC(=C(C=C54)OC)OCCCN6CCN(CC6)CSynonyms(20)
4SC-2034sc 203UNII-RFG3GJ6251Urea, N-(2-methoxy-5-methylphenyl)-N'-(6-((6-methoxy-7-(3-(4-methyl-1-piperazinyl)propoxy)-4-quinazolinyl)amino)-2-benzothiazolyl)-4SC 203 [WHO-DD]1-(2-methoxy-5-methylphenyl)-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea1-(2-methoxy-5-methylphenyl)-3-(6-((6-methoxy-7-(3-(4-methylpiperazin-1-yl)propoxy)quinazolin-4-yl)amino)-1,3-benzothiazol-2-yl)urea1-(2-methoxy-5-methylphenyl)-3-[6-({6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl}amino)-1,3-benzothiazol-2-yl]ureaRefChem:100722Multikinase Inhibitor 4SC-203895533-09-2RFG3GJ6251orb1298072SCHEMBL1505017CHEMBL5314406
Data from PubChem (NCBI)
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