N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide

C173H210ClF9N22O32S2 — CID 160542224

About N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide

N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide (PubChem CID 160542224) has the molecular formula C173H210ClF9N22O32S2 and a molecular weight of 3380.27 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide.

Molecular Properties

• Compound Name: N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide
• PubChem CID: 160542224
• Molecular Formula: C173H210ClF9N22O32S2
• Molecular Weight: 3380.27 g/mol
• Exact Mass: 3377.45
• IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide
• SMILES: Cc1cc(CCCCOCCOCCOCCOCCOCCN2CCN(c3cc(Nc4ncc(C(=O)Nc5c(C)cccc5Cl)s4)nc(C)n3)CC2)c2ccc3c(c2n1)CCC(SCCOCCOCCOCCOCCOCCCC(=O)c1cccc(-c2cc(Cc4ccc(OC(F)(F)F)cc4)ncn2)c1)O3.Cc1ccc(C(=O)Cc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cc(OCCOCCOCCOCCOCCOCCOCCNC(=O)[C@H]3C[C@@H]4C[C@H]3C3=CNN=C(c5cccc(C(=O)CCCOCCOCCOCCOCCOCCOCCNC(=O)c6cccc(-c7cc(Nc8ccc(OC(F)(F)F)cc8)ncn7)c6)c5)C34)cnn12
• InChI: InChI=1S/C94H112F6N12O18.C79H98ClF3N10O14S2/c1-66-11-13-71(86(114)53-67-12-14-74(83(52-67)93(95,96)97)64-111-25-23-110(2)24-26-111)54-68(66)15-18-77-61-103-88-59-79(62-107-112(77)88)129-51-50-128-49-48-127-47-46-126-45-44-125-41-38-122-35-32-119-29-22-102-92(116)81-58-75-57-80(81)82-63-106-109-90(89(75)82)72-8-4-7-70(56-72)85(113)10-5-27-117-30-33-120-36-39-123-42-43-124-40-37-121-34-31-118-28-21-101-91(115)73-9-3-6-69(55-73)84-60-87(105-65-104-84)108-76-16-19-78(20-17-76)130-94(98,99)100;1-56-9-6-13-67(80)75(56)91-77(95)71-54-84-78(109-71)90-72-53-73(89-58(3)88-72)93-25-23-92(24-26-93)27-30-98-33-36-101-39-42-102-40-37-99-34-31-96-28-5-4-10-60-49-57(2)87-76-65(60)19-21-70-66(76)20-22-74(106-70)108-48-47-105-46-45-104-44-43-103-41-38-100-35-32-97-29-8-14-69(94)62-12-7-11-61(51-62)68-52-63(85-55-86-68)50-59-15-17-64(18-16-59)107-79(81,82)83/h3-4,6-9,11-14,16-17,19-20,52,54-56,59-63,65,75,80-81,89,106H,5,10,21-51,53,57-58,64H2,1-2H3,(H,101,115)(H,102,116)(H,104,105,108);6-7,9,11-13,15-19,21,49,51-55,74H,4-5,8,10,14,20,22-48,50H2,1-3H3,(H,91,95)(H,84,88,89,90)/t75-,80+,81-,89?;/m0./s1
• InChIKey: QWXZPMHKDLOGQJ-IOCUAOAFSA-N
• XLogP: 24.34
• TPSA: 573.21 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 53
• Rotatable Bonds: 107
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3380.27
LogP ≤ 5	24.34
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	53

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide?

The IUPAC name of N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide (CID 160542224) is N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide.

What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide?

The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide is Cc1cc(CCCCOCCOCCOCCOCCOCCN2CCN(c3cc(Nc4ncc(C(=O)Nc5c(C)cccc5Cl)s4)nc(C)n3)CC2)c2ccc3c(c2n1)CCC(SCCOCCOCCOCCOCCOCCCC(=O)c1cccc(-c2cc(Cc4ccc(OC(F)(F)F)cc4)ncn2)c1)O3.Cc1ccc(C(=O)Cc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cc(OCCOCCOCCOCCOCCOCCOCCNC(=O)[C@H]3C[C@@H]4C[C@H]3C3=CNN=C(c5cccc(C(=O)CCCOCCOCCOCCOCCOCCOCCNC(=O)c6cccc(-c7cc(Nc8ccc(OC(F)(F)F)cc8)ncn7)c6)c5)C34)cnn12.

What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide?

The InChIKey is QWXZPMHKDLOGQJ-IOCUAOAFSA-N. The full InChI is InChI=1S/C94H112F6N12O18.C79H98ClF3N10O14S2/c1-66-11-13-71(86(114)53-67-12-14-74(83(52-67)93(95,96)97)64-111-25-23-110(2)24-26-111)54-68(66)15-18-77-61-103-88-59-79(62-107-112(77)88)129-51-50-128-49-48-127-47-46-126-45-44-125-41-38-122-35-32-119-29-22-102-92(116)81-58-75-57-80(81)82-63-106-109-90(89(75)82)72-8-4-7-70(56-72)85(113)10-5-27-117-30-33-120-36-39-123-42-43-124-40-37-121-34-31-118-28-21-101-91(115)73-9-3-6-69(55-73)84-60-87(105-65-104-84)108-76-16-19-78(20-17-76)130-94(98,99)100;1-56-9-6-13-67(80)75(56)91-77(95)71-54-84-78(109-71)90-72-53-73(89-58(3)88-72)93-25-23-92(24-26-93)27-30-98-33-36-101-39-42-102-40-37-99-34-31-96-28-5-4-10-60-49-57(2)87-76-65(60)19-21-70-66(76)20-22-74(106-70)108-48-47-105-46-45-104-44-43-103-41-38-100-35-32-97-29-8-14-69(94)62-12-7-11-61(51-62)68-52-63(85-55-86-68)50-59-15-17-64(18-16-59)107-79(81,82)83/h3-4,6-9,11-14,16-17,19-20,52,54-56,59-63,65,75,80-81,89,106H,5,10,21-51,53,57-58,64H2,1-2H3,(H,101,115)(H,102,116)(H,104,105,108);6-7,9,11-13,15-19,21,49,51-55,74H,4-5,8,10,14,20,22-48,50H2,1-3H3,(H,91,95)(H,84,88,89,90)/t75-,80+,81-,89?;/m0./s1.

What are the key properties of N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide?

N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide has a molecular weight of 3380.27 g/mol, XLogP of 24.34, 107 rotatable bonds, 6 hydrogen bond donors, and 53 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[4-[2-[2-[2-[2-[2-[4-[2-methyl-8-[2-[2-[2-[2-[2-[4-oxo-4-[3-[6-[[4-(trifluoromethoxy)phenyl]methyl]pyrimidin-4-yl]phenyl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylsulfanyl]-9,10-dihydro-8H-pyrano[2,3-h]quinolin-4-yl]butoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;(1S,8R,9S)-N-[2-[2-[2-[2-[2-[2-[2-[3-[2-[2-methyl-5-[2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]phenyl]ethynyl]imidazo[1,2-b]pyridazin-7-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[3-[4-[2-[2-[2-[2-[2-[2-[[3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoyl]phenyl]-4,5-diazatricyclo[6.2.1.02,7]undeca-3,6-diene-9-carboxamide is sourced from PubChem (CID 160542224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).