10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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![10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6f8dc769d79043d1af3f76c4a8c0bdde.png "10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine")
10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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CAS No:
575468-55-2
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Formula:
C18H16N6S3
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Chemical Name:
10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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Synonyms:
575468-55-2;10-({[5-(phenylamino)-1,3,4-thiadiazol-2-yl]methyl}sulfanyl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9,11-tetraen-12-amine;2-(((5-(phenylamino)-1,3,4-thiadiazol-2-yl)methyl)thio)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine;{5-[(4-amino(5,6,7-trihydrocyclopenta[1,2-d]pyrimidino[4,5-b]thiophen-2-ylthio ))methyl](1,3,4-thiadiazol-2-yl)}phenylamine;CBKinase1_004712;CBKinase1_017112;SCHEMBL5992992;CHEMBL4537793;ZINC1805298;MFCD03847791;SBB083564;STK845469;AKOS002180778;MCULE-1749689111;ST50069562;VU0049815-2;BRD-K98579150-001-01-7;F3111-1201;{5-[(4-Amino(5,6,7-trihydrocyclopenta[1,2-d]pyrimidino[4,5-b]thiophen-2-ylthio))methyl](1,3,4-thiadiazol-2-yl)}phenylamine;10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine;2-({[5-(phenylamino)-1,3,4-thiadiazol-2-yl]methyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
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CAS No:
10-[(5-anilino-1,3,4-thiadiazol-2-yl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine Basic Attributes
412.6 g/mol
412.05985806 g/mol
Computed Properties
Molecular Weight:412.6
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:412.05985806
Monoisotopic Mass:412.05985806
Topological Polar Surface Area:171
Heavy Atom Count:27
Complexity:508
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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