1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine

C34H24Cl2N10S3 — CID 90900649

IUPAC1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine
SMILESCc1cc(N(c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)N(c2csc(C)n2)c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)ccn1
InChIInChI=1S/C34H24Cl2N10S3/c1-17-11-23(7-10-37-17)45(33-29-31(48-19(3)43-29)24(14-40-33)21-5-8-38-26(35)12-21)46(28-16-47-18(2)42-28)34-30-32(49-20(4)44-30)25(15-41-34)22-6-9-39-27(36)13-22/h5-16H,1-4H3
InChIKeyWCXPXBKSMWIJID-UHFFFAOYSA-N
MW739.74 g/mol
LogP10.10
Rot. Bonds7

About 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine

1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine (PubChem CID 90900649) has the molecular formula C34H24Cl2N10S3 and a molecular weight of 739.74 g/mol. Its IUPAC name is 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine.

Molecular Properties

Compound Name1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine
PubChem CID90900649
Molecular FormulaC34H24Cl2N10S3
Molecular Weight739.74 g/mol
Exact Mass738.07
IUPAC Name1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine
SMILESCc1cc(N(c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)N(c2csc(C)n2)c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)ccn1
InChIInChI=1S/C34H24Cl2N10S3/c1-17-11-23(7-10-37-17)45(33-29-31(48-19(3)43-29)24(14-40-33)21-5-8-38-26(35)12-21)46(28-16-47-18(2)42-28)34-30-32(49-20(4)44-30)25(15-41-34)22-6-9-39-27(36)13-22/h5-16H,1-4H3
InChIKeyWCXPXBKSMWIJID-UHFFFAOYSA-N
XLogP10.10
TPSA109.60 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds7
Heavy Atoms49
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500739.74
LogP ≤ 510.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[3-Chloro-4-(trifluoromethyl)phenyl]-1,2-bis[2-[(2,6-dichlorophenyl)methyl]-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]-2-[6-(trifluoromethyl)-3-pyridinyl]hydrazine
CID 90903649
1-(4-Chloro-1,3-thiazol-2-yl)-2-[5-(5-fluoro-3-pyridinyl)-2-methyl-1,7-naphthyridin-8-yl]-1-(2-methyl-5-pyrimidin-5-yl-1,7-naphthyridin-8-yl)-2-(4-methyl-1,3-thiazol-2-yl)hydrazine
CID 91083879
[7-(2-Chloro-pyridin-4-yl)-2-methyl-thiazolo[4,5-c]pyridin-4-yl]-(2-methyl-pyridin-4-yl)-amine
CID 16661050
[7-(2-Chloro-pyridin-4-yl)-2-methyl-thiazolo[4,5-c]pyridin-4-yl]-(2-methyl-thiazol-4-yl)-amine
CID 16661051
4,6-Dichloro-13-ethyl-11-(4-pyrimidin-2-ylpiperazin-1-yl)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 59755122
2-(4-Chlorophenyl)-7-piperazin-1-yl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine;7-piperazin-1-yl-2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine
CID 67133667
2-methyl-N,N-bis(1-methylpyrazol-3-yl)-7-pyridin-3-yl-[1,3]thiazolo[4,5-c]pyridin-4-amine
CID 69144710
1-(2-Methyl-5-pyridin-4-yl-1,7-naphthyridin-8-yl)-2-(2-methyl-5-pyrimidin-5-yl-1,7-naphthyridin-8-yl)-1,2-bis(4-methyl-1,3-thiazol-2-yl)hydrazine
CID 90786105
1-[2-Methyl-5-(6-methyl-2-pyridinyl)-1,7-naphthyridin-8-yl]-1-(2-methyl-1,3-thiazol-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)-2-[2-methyl-5-(1,3-thiazol-2-yl)-1,7-naphthyridin-8-yl]hydrazine
CID 90806007
1-(2-Methylpyrimidin-4-yl)-1,2-bis(2-methyl-7-pyrimidin-5-yl-[1,3]thiazolo[4,5-c]pyridin-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)hydrazine
CID 90891605
1-(6-Chloro-3-pyridinyl)-2-(6-pyrrolidin-1-yl-3-pyridinyl)-1,2-bis[4-(1,3-thiazol-2-yl)pyrimidin-2-yl]hydrazine
CID 90926681
1,2-Bis(2-chloro-1,7-naphthyridin-8-yl)-1-(2-methyl-1,3-thiazol-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)hydrazine
CID 91396132

Frequently Asked Questions

What is the IUPAC name of 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine?
The IUPAC name of 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine (CID 90900649) is 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine.
What is the SMILES notation for 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine?
The canonical SMILES for 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine is Cc1cc(N(c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)N(c2csc(C)n2)c2ncc(-c3ccnc(Cl)c3)c3sc(C)nc23)ccn1.
What is the InChIKey of 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine?
The InChIKey is WCXPXBKSMWIJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24Cl2N10S3/c1-17-11-23(7-10-37-17)45(33-29-31(48-19(3)43-29)24(14-40-33)21-5-8-38-26(35)12-21)46(28-16-47-18(2)42-28)34-30-32(49-20(4)44-30)25(15-41-34)22-6-9-39-27(36)13-22/h5-16H,1-4H3.
What are the key properties of 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine?
1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine has a molecular weight of 739.74 g/mol, XLogP of 10.10, 7 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis[7-(2-chloro-4-pyridinyl)-2-methyl-[1,3]thiazolo[4,5-c]pyridin-4-yl]-1-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)hydrazine is sourced from PubChem (CID 90900649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).