N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide

C112H122N22O12S5 — CID 157288494

IUPACN-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide
SMILESCS(=O)(=O)Nc1cccc(CNC(=O)c2ccc(-c3ccnc(Nc4cccc(CCN5CCOCC5)c4)n3)s2)c1.O=C(NCCCCO)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(NCc1ccc2cc[nH]c2c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(Nc1cccc(CO)c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1
InChIInChI=1S/C30H30N6O2S.C29H32N6O4S2.C28H29N5O3S.C25H31N5O3S/c37-29(33-20-22-4-5-23-8-11-31-26(23)19-22)28-7-6-27(39-28)25-9-12-32-30(35-25)34-24-3-1-2-21(18-24)10-13-36-14-16-38-17-15-36;1-41(37,38)34-24-7-3-5-22(19-24)20-31-28(36)27-9-8-26(40-27)25-10-12-30-29(33-25)32-23-6-2-4-21(18-23)11-13-35-14-16-39-17-15-35;34-19-21-4-2-5-22(18-21)30-27(35)26-8-7-25(37-26)24-9-11-29-28(32-24)31-23-6-1-3-20(17-23)10-12-33-13-15-36-16-14-33;31-15-2-1-10-26-24(32)23-7-6-22(34-23)21-8-11-27-25(29-21)28-20-5-3-4-19(18-20)9-12-30-13-16-33-17-14-30/h1-9,11-12,18-19,31H,10,13-17,20H2,(H,33,37)(H,32,34,35);2-10,12,18-19,34H,11,13-17,20H2,1H3,(H,31,36)(H,30,32,33);1-9,11,17-18,34H,10,12-16,19H2,(H,30,35)(H,29,31,32);3-8,11,18,31H,1-2,9-10,12-17H2,(H,26,32)(H,27,28,29)
InChIKeyBANBXQKKWIDDID-UHFFFAOYSA-N
MW2128.68 g/mol
LogP17.25
Rot. Bonds40

About N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide

N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide (PubChem CID 157288494) has the molecular formula C112H122N22O12S5 and a molecular weight of 2128.68 g/mol. Its IUPAC name is N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide
PubChem CID157288494
Molecular FormulaC112H122N22O12S5
Molecular Weight2128.68 g/mol
Exact Mass2126.82
IUPAC NameN-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide
SMILESCS(=O)(=O)Nc1cccc(CNC(=O)c2ccc(-c3ccnc(Nc4cccc(CCN5CCOCC5)c4)n3)s2)c1.O=C(NCCCCO)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(NCc1ccc2cc[nH]c2c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(Nc1cccc(CO)c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1
InChIInChI=1S/C30H30N6O2S.C29H32N6O4S2.C28H29N5O3S.C25H31N5O3S/c37-29(33-20-22-4-5-23-8-11-31-26(23)19-22)28-7-6-27(39-28)25-9-12-32-30(35-25)34-24-3-1-2-21(18-24)10-13-36-14-16-38-17-15-36;1-41(37,38)34-24-7-3-5-22(19-24)20-31-28(36)27-9-8-26(40-27)25-10-12-30-29(33-25)32-23-6-2-4-21(18-23)11-13-35-14-16-39-17-15-35;34-19-21-4-2-5-22(18-21)30-27(35)26-8-7-25(37-26)24-9-11-29-28(32-24)31-23-6-1-3-20(17-23)10-12-33-13-15-36-16-14-33;31-15-2-1-10-26-24(32)23-7-6-22(34-23)21-8-11-27-25(29-21)28-20-5-3-4-19(18-20)9-12-30-13-16-33-17-14-30/h1-9,11-12,18-19,31H,10,13-17,20H2,(H,33,37)(H,32,34,35);2-10,12,18-19,34H,11,13-17,20H2,1H3,(H,31,36)(H,30,32,33);1-9,11,17-18,34H,10,12-16,19H2,(H,30,35)(H,29,31,32);3-8,11,18,31H,1-2,9-10,12-17H2,(H,26,32)(H,27,28,29)
InChIKeyBANBXQKKWIDDID-UHFFFAOYSA-N
XLogP17.25
TPSA419.94 Ų
H-Bond Donors12
H-Bond Acceptors32
Rotatable Bonds40
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002128.68
LogP ≤ 517.25
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide with MolForge

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Related Compounds

2-(5-acetylthiophen-2-yl)acetic acid;[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] 2-[5-[2-[3-(hydroxymethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]acetate;2-[5-[2-[3-(hydroxymethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]acetic acid;2-[5-[2-[3-(hydroxymethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]-N-methyl-N-phenylacetamide;1-[5-[(4-methyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)methyl]thiophen-2-yl]ethanone
CID 157284490
1,3-Dihydroisoindol-2-yl-[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]methanone;(5-ethyl-2-methylpiperidin-1-yl)-[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]methanone;[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]-(3-methoxypyrrolidin-1-yl)methanone
CID 157434599
N-benzyl-5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]-N-methylthiophene-3-carboxamide;N-[(4-ethylpiperazin-1-yl)methyl]-5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophene-3-carboxamide;5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide
CID 157437469
N-[4-(dimethylamino)butyl]-5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-4-ylmethyl)-5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide
CID 157829362
4-(Dimethylamino)-1-[3-[3-[5-(2,6-dimethylphenyl)thiophen-2-yl]anilino]phenyl]butan-1-one;[3-[3-[5-(2-ethylphenyl)thiophen-2-yl]anilino]phenyl]-[4-(3-methylbutyl)cyclohexyl]methanone;[4-[5-[2-[[3-(1-hydroxyethyl)phenyl]methyl]pyrimidin-4-yl]thiophen-2-yl]phenyl]-morpholin-4-ylmethanone;1-[4-[5-[2-[[3-(1-hydroxyethyl)phenyl]methyl]pyrimidin-4-yl]thiophen-2-yl]phenyl]propan-1-one
CID 157895507
4-[5-(2-ethylphenyl)thiophen-2-yl]-N-[3-(morpholin-4-ylmethyl)phenyl]pyrimidin-2-amine;3-[[4-[5-(2-ethylphenyl)thiophen-2-yl]pyrimidin-2-yl]amino]-N,N-dimethylbenzamide;[3-[[4-[5-(2-ethylphenyl)thiophen-2-yl]pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone;2-[3-[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]phenyl]acetonitrile;1-[3-[[4-[5-[2-(methoxymethyl)phenyl]thiophen-2-yl]pyrimidin-2-yl]amino]phenyl]ethanol
CID 157928042
N-benzyl-5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]-N-methylthiophene-3-carboxamide;N-benzyl-5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophene-3-carboxamide;(4-ethylpiperazin-1-yl)-[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-3-yl]methanone;5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide;[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-3-yl]-piperidin-1-ylmethanone
CID 158066869
N-[3-(hydroxymethyl)cyclohexyl]-5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(hydroxymethyl)phenyl]methyl]-5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;5-[2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]-N-(1-phenyl-2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide
CID 158227216
N-[(3-acetamidophenyl)methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(dimethylamino)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(hydroxymethyl)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[2-(3-hydroxyphenyl)ethyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide
CID 158606459
N-(3-carbamoylphenyl)-2-(4-propan-2-ylsulfonylphenyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;N-[(2R)-2-hydroxy-2-phenylethyl]-2-(4-propan-2-ylsulfonylphenyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;molecular hydrogen;N-[(4-morpholin-4-ylphenyl)methyl]-2-(4-propan-2-ylsulfonylphenyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;N-[(1S)-1-phenylethyl]-2-(4-propan-2-ylsulfonylphenyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
CID 158681277
N-(4-hydroxycyclohexyl)-2-(3-methylsulfonylanilino)thieno[2,3-h]quinazoline-8-carboxamide;N-(2-hydroxyethyl)-N-methyl-2-(3-methylsulfonylanilino)thieno[2,3-h]quinazoline-8-carboxamide;(4-hydroxypiperidin-1-yl)-[2-(3-methylsulfonylanilino)thieno[2,3-h]quinazolin-8-yl]methanone;N-[(2S)-1-methoxypropan-2-yl]-2-(3-methylsulfonylanilino)thieno[2,3-h]quinazoline-8-carboxamide;2-(3-methylsulfonylanilino)-N-(oxan-4-yl)thieno[2,3-h]quinazoline-8-carboxamide
CID 158961236
1,3-Dihydroisoindol-2-yl-[5-[3-[(3-propan-2-ylphenyl)methyl]phenyl]thiophen-2-yl]methanone;(5-ethyl-2-methylpiperidin-1-yl)-[5-[2-[3-(1-hydroxyethyl)anilino]pyrimidin-4-yl]thiophen-2-yl]methanone;[5-[2-[[3-(1-hydroxyethyl)phenyl]methyl]pyrimidin-4-yl]thiophen-2-yl]-(3-methylpyrrolidin-1-yl)methanone;3-phenyl-1-[5-[3-[(3-propan-2-ylphenyl)methyl]phenyl]thiophen-2-yl]butan-1-one
CID 159165752

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide?
The IUPAC name of N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide (CID 157288494) is N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide?
The canonical SMILES for N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide is CS(=O)(=O)Nc1cccc(CNC(=O)c2ccc(-c3ccnc(Nc4cccc(CCN5CCOCC5)c4)n3)s2)c1.O=C(NCCCCO)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(NCc1ccc2cc[nH]c2c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.O=C(Nc1cccc(CO)c1)c1ccc(-c2ccnc(Nc3cccc(CCN4CCOCC4)c3)n2)s1.
What is the InChIKey of N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide?
The InChIKey is BANBXQKKWIDDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30N6O2S.C29H32N6O4S2.C28H29N5O3S.C25H31N5O3S/c37-29(33-20-22-4-5-23-8-11-31-26(23)19-22)28-7-6-27(39-28)25-9-12-32-30(35-25)34-24-3-1-2-21(18-24)10-13-36-14-16-38-17-15-36;1-41(37,38)34-24-7-3-5-22(19-24)20-31-28(36)27-9-8-26(40-27)25-10-12-30-29(33-25)32-23-6-2-4-21(18-23)11-13-35-14-16-39-17-15-35;34-19-21-4-2-5-22(18-21)30-27(35)26-8-7-25(37-26)24-9-11-29-28(32-24)31-23-6-1-3-20(17-23)10-12-33-13-15-36-16-14-33;31-15-2-1-10-26-24(32)23-7-6-22(34-23)21-8-11-27-25(29-21)28-20-5-3-4-19(18-20)9-12-30-13-16-33-17-14-30/h1-9,11-12,18-19,31H,10,13-17,20H2,(H,33,37)(H,32,34,35);2-10,12,18-19,34H,11,13-17,20H2,1H3,(H,31,36)(H,30,32,33);1-9,11,17-18,34H,10,12-16,19H2,(H,30,35)(H,29,31,32);3-8,11,18,31H,1-2,9-10,12-17H2,(H,26,32)(H,27,28,29).
What are the key properties of N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide?
N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide has a molecular weight of 2128.68 g/mol, XLogP of 17.25, 40 rotatable bonds, 12 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxybutyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[3-(hydroxymethyl)phenyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-(1H-indol-6-ylmethyl)-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide;N-[[3-(methanesulfonamido)phenyl]methyl]-5-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]thiophene-2-carboxamide is sourced from PubChem (CID 157288494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).