1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine

C129H213N33O8S4 — CID 157150757

IUPAC1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine
SMILESC1N=NNN1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1ncncn1.Cn1cnnc1.c1c[nH]cn1.c1cc[nH]c1.c1ccc2[nH]ccc2c1.c1ccc2c(c1)CCO2.c1ccc2c(c1)OCO2.c1ccc2nonc2c1.c1ccc2scnc2c1.c1ccncc1.c1ccoc1.c1ccsc1.c1cnccn1.c1cncnc1.c1cnncn1.c1cocn1.c1cscn1.c1ncon1.c1nnco1.c1nncs1
InChIInChI=1S/C8H7N.C8H8O.C7H5NS.C7H6O2.C6H9N3.C6H4N2O.C5H5N.2C4H4N2.C4H5N.C4H4O.C4H4S.C3H5N3.C3H3N3.C3H4N2.C3H3NO.C3H3NS.2C2H2N2O.C2H2N2S.20C2H6.CH4N4/c2*1-2-4-8-7(3-1)5-6-9-8;2*1-2-4-7-6(3-1)8-5-9-7;1-5(2)6-8-3-7-4-9-6;1-2-4-6-5(3-1)7-9-8-6;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-2-5-4-6-3-1;3*1-2-4-5-3-1;1-6-2-4-5-3-6;1-2-5-6-3-4-1;3*1-2-5-3-4-1;1-3-4-2-5-1;1-3-2-5-4-1;1-3-4-2-5-1;20*1-2;1-2-4-5-3-1/h1-6,9H;1-4H,5-6H2;1-5H;1-4H,5H2;3-5H,1-2H3;1-4H;1-5H;2*1-4H;1-5H;2*1-4H;2-3H,1H3;1-3H;1-3H,(H,4,5);2*1-3H;3*1-2H;20*1-2H3;1H2,(H,2,5)(H,3,4)
InChIKeyALFOUMSMZMEFFJ-UHFFFAOYSA-N
MW2482.61 g/mol
LogP38.33
Rot. Bonds1

About 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine

1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine (PubChem CID 157150757) has the molecular formula C129H213N33O8S4 and a molecular weight of 2482.61 g/mol. Its IUPAC name is 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine.

Molecular Properties

Compound Name1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine
PubChem CID157150757
Molecular FormulaC129H213N33O8S4
Molecular Weight2482.61 g/mol
Exact Mass2480.62
IUPAC Name1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine
SMILESC1N=NNN1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1ncncn1.Cn1cnnc1.c1c[nH]cn1.c1cc[nH]c1.c1ccc2[nH]ccc2c1.c1ccc2c(c1)CCO2.c1ccc2c(c1)OCO2.c1ccc2nonc2c1.c1ccc2scnc2c1.c1ccncc1.c1ccoc1.c1ccsc1.c1cnccn1.c1cncnc1.c1cnncn1.c1cocn1.c1cscn1.c1ncon1.c1nnco1.c1nncs1
InChIInChI=1S/C8H7N.C8H8O.C7H5NS.C7H6O2.C6H9N3.C6H4N2O.C5H5N.2C4H4N2.C4H5N.C4H4O.C4H4S.C3H5N3.C3H3N3.C3H4N2.C3H3NO.C3H3NS.2C2H2N2O.C2H2N2S.20C2H6.CH4N4/c2*1-2-4-8-7(3-1)5-6-9-8;2*1-2-4-7-6(3-1)8-5-9-7;1-5(2)6-8-3-7-4-9-6;1-2-4-6-5(3-1)7-9-8-6;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-2-5-4-6-3-1;3*1-2-4-5-3-1;1-6-2-4-5-3-6;1-2-5-6-3-4-1;3*1-2-5-3-4-1;1-3-4-2-5-1;1-3-2-5-4-1;1-3-4-2-5-1;20*1-2;1-2-4-5-3-1/h1-6,9H;1-4H,5-6H2;1-5H;1-4H,5H2;3-5H,1-2H3;1-4H;1-5H;2*1-4H;1-5H;2*1-4H;2-3H,1H3;1-3H;1-3H,(H,4,5);2*1-3H;3*1-2H;20*1-2H3;1H2,(H,2,5)(H,3,4)
InChIKeyALFOUMSMZMEFFJ-UHFFFAOYSA-N
XLogP38.33
TPSA516.72 Ų
H-Bond Donors5
H-Bond Acceptors42
Rotatable Bonds1
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002482.61
LogP ≤ 538.33
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1042

Analyze 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine with MolForge

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Related Compounds

benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;2,3-dihydro-1-benzofuran;1,4-dimethoxybenzene;ethane;furan;bis(1H-indole);1-methylimidazole;1-methylindole;4-methylmorpholine;1-methylpiperidine;5-methylpyrimidine;morpholine;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;quinoxaline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;triazine;1,3,5-triazine
CID 157051462
4-tert-butyl-2-methyl-1,3-thiazole;2,2-difluoro-5-methyl-1,3-benzodioxole;1,2-dimethylbenzimidazole;2-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methyl-5-[(4-methylpiperazin-1-yl)methyl]-1,3-thiazole;2-methyl-5-phenyl-1,3,4-oxadiazole;2-methyl-4-phenyl-1,3-oxazole;2-methyl-5-phenyl-1,3-oxazole;5-methyl-1-phenyltetrazole;2-methyl-4-phenyl-1,3-thiazole;2-methyl-5-phenyl-1,3-thiazole;4-[(2-methyl-4-phenyl-1,3-thiazol-5-yl)methyl]morpholine;5-methyl-3-phenyl-1H-1,2,4-triazole;2-methyl-5-(piperidin-1-ylmethyl)-1,3-thiazole;2-methyl-5-[(4-propan-2-ylpiperazin-1-yl)methyl]-1,3-thiazole;2-methyl-1,3-thiazole;4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine;4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 157257748
benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;2,3-dihydro-1-benzofuran;ethane;furan;bis(1H-indole);1-methoxy-4-methylbenzene;1-methylimidazole;1-methylindole;bis(1-methylpiperidine);5-methylpyrimidine;morpholine;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;quinoxaline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;1,2,4-triazine;1,3,5-triazine
CID 157327103
benzene;1,3-benzodioxole;tris(1-benzothiophene);bis(cyclopenta-1,3-diene);2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;2,3-dihydro-1-benzofuran;ethane;furan;bis(1H-indole);methane;1-methylimidazole;1-methylindole;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;bis(piperidine);pyridine;pyrimidine;quinazoline;quinoline;quinoxaline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;thieno[3,2-c]pyridine;1,2,4-triazine;1,3,5-triazine
CID 157505301
benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;dibenzofuran;dibenzothiophene;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;ethane;9H-fluorene;furan;bis(1H-indole);1-methylimidazole;1-methylindole;morpholine;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;triazine;1,3,5-triazine
CID 157518381
5-(azepan-1-ylmethyl)-2-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;2,2-difluoro-5-methyl-1,3-benzodioxole;1,2-dimethylbenzimidazole;2-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methyl-5-[(4-methylpiperazin-1-yl)methyl]-1,3-thiazole;2-methyl-5-phenyl-1,3,4-oxadiazole;2-methyl-4-phenyl-1,3-oxazole;2-methyl-5-phenyl-1,3-oxazole;5-methyl-1-phenyltetrazole;2-methyl-4-phenyl-1,3-thiazole;2-methyl-5-phenyl-1,3-thiazole;4-[(2-methyl-4-phenyl-1,3-thiazol-5-yl)methyl]morpholine;5-methyl-3-phenyl-1H-1,2,4-triazole;2-methyl-5-(piperidin-1-ylmethyl)-1,3-thiazole;2-methyl-5-[(4-propan-2-ylpiperazin-1-yl)methyl]-1,3-thiazole;2-methyl-1,3-thiazole;4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine;4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 158180810
CID 158239552
CID 158239552
benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;dibenzofuran;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;ethane;9H-fluorene;furan;bis(1H-indole);1-methylimidazole;1-methylindole;morpholine;oxane;bis(1,3-oxazole);[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;thiane;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;1,2,4-triazine;1,3,5-triazine
CID 158627228
benzene;1,3-benzodioxole;1,3-benzothiazole;bis(1-benzothiophene);bis(cyclopenta-1,3-diene);2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;5,6-dihydro-1H-indole;ethane;9H-fluorene;furan;1H-indole;methane;1-methylimidazole;1-methylindole;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;bis(piperidine);pyridine;pyrimidine;quinazoline;quinoline;quinoxaline;thiane;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,2,4-triazine;1,3,5-triazine
CID 158707597
cumene;methane;2-methyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;5-propan-2-yl-1,2,4-oxadiazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;bis(5-propan-2-yl-1H-pyrazole);bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1,2,4-thiadiazole;bis(2-propan-2-yl-1,3-thiazole);bis(2-propan-2-ylthiophene);2-propan-2-yl-5-(trifluoromethyl)-1,3-thiazole
CID 159939351
1H-benzimidazole;1,3-benzodioxole;1-benzofuran;1,3-benzothiazole;1-benzothiophene;2H-benzotriazole;1,3-benzoxazole;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;1,3-dihydro-2-benzofuran;2,3-dihydro-1-benzofuran;3,4-dihydro-2H-chromene;3,4-dihydro-2H-thiochromene;1H-indazole;1H-indole;quinazoline;quinoline;quinoxaline;2,2,3,3-tetrafluoro-1,4-benzodioxine
CID 160229436
benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;dibenzofuran;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;ethane;9H-fluorene;furan;bis(1H-indole);1-methylimidazole;1-methylindole;morpholine;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;1,2,4-triazine;1,3,5-triazine
CID 160394850

Frequently Asked Questions

What is the IUPAC name of 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine?
The IUPAC name of 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine (CID 157150757) is 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine.
What is the SMILES notation for 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine?
The canonical SMILES for 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine is C1N=NNN1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1ncncn1.Cn1cnnc1.c1c[nH]cn1.c1cc[nH]c1.c1ccc2[nH]ccc2c1.c1ccc2c(c1)CCO2.c1ccc2c(c1)OCO2.c1ccc2nonc2c1.c1ccc2scnc2c1.c1ccncc1.c1ccoc1.c1ccsc1.c1cnccn1.c1cncnc1.c1cnncn1.c1cocn1.c1cscn1.c1ncon1.c1nnco1.c1nncs1.
What is the InChIKey of 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine?
The InChIKey is ALFOUMSMZMEFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N.C8H8O.C7H5NS.C7H6O2.C6H9N3.C6H4N2O.C5H5N.2C4H4N2.C4H5N.C4H4O.C4H4S.C3H5N3.C3H3N3.C3H4N2.C3H3NO.C3H3NS.2C2H2N2O.C2H2N2S.20C2H6.CH4N4/c2*1-2-4-8-7(3-1)5-6-9-8;2*1-2-4-7-6(3-1)8-5-9-7;1-5(2)6-8-3-7-4-9-6;1-2-4-6-5(3-1)7-9-8-6;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-2-5-4-6-3-1;3*1-2-4-5-3-1;1-6-2-4-5-3-6;1-2-5-6-3-4-1;3*1-2-5-3-4-1;1-3-4-2-5-1;1-3-2-5-4-1;1-3-4-2-5-1;20*1-2;1-2-4-5-3-1/h1-6,9H;1-4H,5-6H2;1-5H;1-4H,5H2;3-5H,1-2H3;1-4H;1-5H;2*1-4H;1-5H;2*1-4H;2-3H,1H3;1-3H;1-3H,(H,4,5);2*1-3H;3*1-2H;20*1-2H3;1H2,(H,2,5)(H,3,4).
What are the key properties of 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine?
1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine has a molecular weight of 2482.61 g/mol, XLogP of 38.33, 1 rotatable bonds, 5 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-benzodioxole;1,3-benzothiazole;2,1,3-benzoxadiazole;2,3-dihydro-1-benzofuran;2,5-dihydro-1H-tetrazole;ethane;furan;1H-imidazole;1H-indole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,3-oxazole;2-propan-2-yl-1,3,5-triazine;pyrazine;pyridine;pyrimidine;1H-pyrrole;1,3,4-thiadiazole;1,3-thiazole;thiophene;1,2,4-triazine is sourced from PubChem (CID 157150757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).